Registration Dossier

Diss Factsheets

Identification

Display Name:
Esterification reaction of fatty acids, C16-18 and C18-unsatd.; 3,4-epoxycyclohexyl methyl-3,4-epoxycyclohexan carboxylate and neodecanoic acid, oxiranylmethyl ester
EC Number:
917-830-2
CAS Number:
1186514-91-9
Molecular formula:
not available for UVCB substances
IUPAC Name:
Esterification reaction of fatty acids, C16-18 and C18-unsatd.; 3,4-epoxycyclohexyl methyl-3,4-epoxycyclohexan carboxylate and neodecanoic acid, oxiranylmethyl ester

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers

Compositions

Boundary Composition(s) open all close all

State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
(3,4-dihydroxycyclohexyl)methyl 3,4-dihydroxycyclohexanecarboxylate
EC Number:
304-388-5
EC Name:
(3,4-dihydroxycyclohexyl)methyl 3,4-dihydroxycyclohexanecarboxylate
CAS Number:
94249-14-6
Molecular formula:
C14H24O6
IUPAC Name:
(3,4-dihydroxycyclohexyl)methyl 3,4-dihydroxycyclohexanecarboxylate
Constituent 2
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid
Molecular formula:
C50H84O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid
Constituent 3
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol oleic acid
Molecular formula:
C50H86O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol oleic acid
Constituent 4
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid
Molecular formula:
C50H88O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid
Constituent 5
Chemical structure
Reference substance name:
2,3-epoxypropyl neodecanoate ester with linoleic acid
Molecular formula:
C31H56O5
IUPAC Name:
2,3-epoxypropyl neodecanoate ester with linoleic acid
Constituent 6
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid 1 mol palmitic acid
Molecular formula:
C48H84O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid 1 mol palmitic acid
Constituent 7
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid 1 mol oleic acid
Molecular formula:
C68H116O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid 1 mol oleic acid
Constituent 8
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 3 mol linoleic acid
Molecular formula:
C68H114O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 3 mol linoleic acid
Constituent 9
Chemical structure
Reference substance name:
Glycidyl neodecanoate, ester with oleic acid
Molecular formula:
C31 H58 O5
IUPAC Name:
Glycidyl neodecanoate, ester with oleic acid
Constituent 10
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol water
Molecular formula:
C32H54O7
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol water
Constituent 11
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 2 mol oleic acid
Molecular formula:
C68H118O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 2 mol oleic acid
Constituent 12
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol oleic acid and 1 mol palmitic acid
Molecular formula:
C48H86O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol oleic acid and 1 mol palmitic acid
Constituent 13
Reference substance name:
Unassigned substance with molar mass 954
Molecular formula:
unknown
IUPAC Name:
Unassigned substance with molar mass 954
Constituent 14
Reference substance name:
Unassigned substance with molar mass 592
Molecular formula:
unknown
IUPAC Name:
Unassigned substance with molar mass 592
Constituent 15
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid and 1 mol stearic acid
Molecular formula:
C68H122O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid and 1 mol stearic acid
Constituent 16
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol oleic acid and 1 mol water
Molecular formula:
C32H56O7
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol oleic acid and 1 mol water
Constituent 17
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid and 1 mol palmitic acid
Molecular formula:
C66H14O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid and 1 mol palmitic acid
Constituent 18
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid, 1 mol oleic acid and 1 mol palmitic acid
Molecular formula:
C66H116O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid, 1 mol oleic acid and 1 mol palmitic acid
Constituent 19
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 3 mol oleic acid
Molecular formula:
C68H120O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 3 mol oleic acid
Constituent 20
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol linolenic acid
Molecular formula:
C50H82O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol linolenic acid
Constituent 21
Reference substance name:
Unassigned substance with molar mass 650
Molecular formula:
unknown
IUPAC Name:
Unassigned substance with molar mass 650
Constituent 22
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid and 1 mol palmitic acid
Molecular formula:
C66H118O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid and 1 mol palmitic acid
Constituent 23
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol stearic acid and 1 mol palmitic acid
Molecular formula:
C48H88O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol stearic acid and 1 mol palmitic acid
Constituent 24
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol stearic acid and 1 mol water
Molecular formula:
C32H58O7
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol stearic acid and 1 mol water
Constituent 25
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linolenic acid and 1 mol palmitic acid
Molecular formula:
C48H82O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linolenic acid and 1 mol palmitic acid

Legal Entity Composition(s) open all close all

State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
(3,4-dihydroxycyclohexyl)methyl 3,4-dihydroxycyclohexanecarboxylate
EC Number:
304-388-5
EC Name:
(3,4-dihydroxycyclohexyl)methyl 3,4-dihydroxycyclohexanecarboxylate
CAS Number:
94249-14-6
Molecular formula:
C14H24O6
IUPAC Name:
(3,4-dihydroxycyclohexyl)methyl 3,4-dihydroxycyclohexanecarboxylate
Constituent 2
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid
Molecular formula:
C50H84O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid
Constituent 3
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol oleic acid
Molecular formula:
C50H86O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol oleic acid
Constituent 4
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid
Molecular formula:
C50H88O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid
Constituent 5
Chemical structure
Reference substance name:
2,3-epoxypropyl neodecanoate ester with linoleic acid
Molecular formula:
C31H56O5
IUPAC Name:
2,3-epoxypropyl neodecanoate ester with linoleic acid
Constituent 6
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid 1 mol palmitic acid
Molecular formula:
C48H84O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid 1 mol palmitic acid
Constituent 7
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid 1 mol oleic acid
Molecular formula:
C68H116O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid 1 mol oleic acid
Constituent 8
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 3 mol linoleic acid
Molecular formula:
C68H114O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 3 mol linoleic acid
Constituent 9
Chemical structure
Reference substance name:
Glycidyl neodecanoate, ester with oleic acid
Molecular formula:
C31 H58 O5
IUPAC Name:
Glycidyl neodecanoate, ester with oleic acid
Constituent 10
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol water
Molecular formula:
C32H54O7
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol water
Constituent 11
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 2 mol oleic acid
Molecular formula:
C68H118O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 2 mol oleic acid
Constituent 12
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol oleic acid and 1 mol palmitic acid
Molecular formula:
C48H86O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol oleic acid and 1 mol palmitic acid
Constituent 13
Reference substance name:
Unassigned substance with molar mass 954
Molecular formula:
unknown
IUPAC Name:
Unassigned substance with molar mass 954
Constituent 14
Reference substance name:
Unassigned substance with molar mass 592
Molecular formula:
unknown
IUPAC Name:
Unassigned substance with molar mass 592
Constituent 15
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid and 1 mol stearic acid
Molecular formula:
C68H122O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid and 1 mol stearic acid
Constituent 16
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol oleic acid and 1 mol water
Molecular formula:
C32H56O7
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol oleic acid and 1 mol water
Constituent 17
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid and 1 mol palmitic acid
Molecular formula:
C66H14O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol linoleic acid and 1 mol palmitic acid
Constituent 18
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid, 1 mol oleic acid and 1 mol palmitic acid
Molecular formula:
C66H116O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid, 1 mol oleic acid and 1 mol palmitic acid
Constituent 19
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 3 mol oleic acid
Molecular formula:
C68H120O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 3 mol oleic acid
Constituent 20
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol linolenic acid
Molecular formula:
C50H82O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linoleic acid and 1 mol linolenic acid
Constituent 21
Reference substance name:
Unassigned substance with molar mass 650
Molecular formula:
unknown
IUPAC Name:
Unassigned substance with molar mass 650
Constituent 22
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid and 1 mol palmitic acid
Molecular formula:
C66H118O9
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 2 mol oleic acid and 1 mol palmitic acid
Constituent 23
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol stearic acid and 1 mol palmitic acid
Molecular formula:
C48H88O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol stearic acid and 1 mol palmitic acid
Constituent 24
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol stearic acid and 1 mol water
Molecular formula:
C32H58O7
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol stearic acid and 1 mol water
Constituent 25
Chemical structure
Reference substance name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linolenic acid and 1 mol palmitic acid
Molecular formula:
C48H82O8
IUPAC Name:
7-oxabicyclo[4.1.0]hept-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, reaction product with 1 mol linolenic acid and 1 mol palmitic acid

Composition(s) generated upon use

Other types of composition(s)