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Reference substances

Reference substances

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General information

Inventory

EC number:
261-674-1
EC name:
Isodecyl 3,5,5-trimethylhexanoate
CAS number:
59231-35-5

No inventory information available

Reference substance information

IUPAC name:
Isodecyl 3,5,5-trimethylhexanoate
Synonyms
Names:
Hexanoic acid, 3,5,5-trimethyl-, isodecyl ester
Identifier:
IUPAC name
8-methylnonyl 3,5,5-trimethylhexanoate

CAS information

CAS number:
59231-35-5

Molecular and structural information

Molecular formula:
C19H38O2
Molecular weight:
298.504
SMILES notation:
CC(C)CCCCCCCOC(=O)CC(C)CC(C)(C)C
InChl:
InChI=1/C19H38O2/c1-16(2)12-10-8-7-9-11-13-21-18(20)14-17(3)15-19(4,5)6/h16-17H,7-15H2,1-6H3
Structural formula:
Chemical structure