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(9Z)-9-Octadecen-1-yl docosanoate

HCID 6437101
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Basic information

CAS
66161-52-2
Standard SMILES
CCCCCCCC/C=C\CCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC
InChIKey
AOXNDJKHXBKZBT-ZZEZOPTASA-N
Molecular formula
C40H78O2
Average molar mass
591.062 g/mol
Monoisotopic mass
590.60018174

Names & identifiers

Preferred name
(9Z)-9-Octadecen-1-yl docosanoate
IUPAC
(9Z)-Octadec-9-en-1-yl docosanoate
English name
(Z)-octadec-9-enyl docosanoate
Molecular formula
C40H78O2
Molecular weight
591.05

Names & synonyms

Einecs 266-186-29-OCTADECENYL DOCOSANOATE)(Z)-octadec-9-enyl docosanoateDocosanoic acid (Z)-9-octadecenyl esterDocosanoic acid, (9Z)-9-octadecenyl esterDocosanoic acid, (9Z)-9-octadecen-1-yl ester

Database identifiers

CAS
66161-52-2
PubChem CID
6437101
DTXSID
DTXSID30886798
ChEBI
CHEBI:165697
UNII
3CNO1063QQ
EC Number
266-186-2
Nikkaji
J286.692G

Properties

Physicochemical properties

Boiling point
638.6 · 638.6±34.0 °C(Predicted)
Density
0.861 · 0.861±0.06 g/cm3(Predicted)
LogP
19.319 · 19.319 (est)
FDA UNII
3 CNO1063QQ · 3CNO1063QQ
EPA Substance Registry System
Oleyl behenate (66161-52-2)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Applications

UsesOleyl behenate is an ester product.

Suppliers2 total

Alfa Chemistry1-516-6625404 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]

Additional notes

DefinitionChEBI: Oleyl behenate is a wax ester.

Related reactions

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Compound notes

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