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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
Propan-2-yl 16-methylheptadecanoate

Inventory

EC number:
269-023-3
EC name:
Isopropyl isodecanoate
CAS number:
68171-33-5
CAS number:
68171-33-5
Synonyms
Names:
Identifier:
IUPAC name
68171-33-5
Identifier:
IUPAC name
C11-22, branched, saturated and unsaturated, isopropyl esters
Identifier:
IUPAC name
C11-22, branched, saturated and unsaturated, isopropyl esters
Identifier:
IUPAC name
Isooctadecanoic acid, ester with isopropanol
Identifier:
IUPAC name
Isopropyl isostearate
Identifier:
IUPAC name
isopropyl isooctadecanoate
Identifier:
other: SMILES notation
CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C
Identifier:
other: Molecular formula
UVCB
Identifier:
other: SMILES notation
UVCB
Identifier:
other: Molecular formula
substance is UVCB
Identifier:
other: SMILES notation
substance is UVCB
Identifier:
other: InChl
substance is UVCB

Molecular and structural information

Molecular formula:
C21H42O2
Molecular weight:
ca. 326.56
SMILES notation:
CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C
InChl:
1S/C21H42O2/c1-19(2)17-15-13-11-9-7-5-6-8-10-12-14-16-18-21(22)23-20(3)4/h19-20H,5-18H2,1-4H3
Structural formula:
Chemical structure

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