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Reference substances

Reference substances

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General information

Inventory

EC number:
217-421-2
EC name:
Octabenzone
CAS number:
1843-05-6

No inventory information available

Reference substance information

IUPAC name:
2-benzoyl-5-(octyloxy)phenol
Synonyms
Names:
Benzophenone, 2-hydroxy-4-(octyloxy)-
Methanone, [2-hydroxy-4-(octyloxy)phenyl]phenyl-
TK 10050
Identifier:
CAS number
1843-05-6
Identifier:
IUPAC name
2-benzoyl-5-(octyloxy)phenol
Identifier:
IUPAC name
[2-hydroxy-4-(octyloxy)phenyl](phenyl)methanone
(2-hydroxy-4-octoxyphenyl)phenylmethanone

CAS information

CAS number:
1843-05-6

Molecular and structural information

Molecular formula:
C21H26O3
Molecular weight:
326.429
SMILES notation:
CCCCCCCCOc1ccc(C(=O)c2ccccc2)c(O)c1
InChl:
InChI=1/C21H26O3/c1-2-3-4-5-6-10-15-24-18-13-14-19(20(22)16-18)21(23)17-11-8-7-9-12-17/h7-9,11-14,16,22H,2-6,10,15H2,1H3
Structural formula:
Chemical structure