Ethyl palmitoleate

HCID 6436624

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Basic information

CAS: 56219-10-4
Standard SMILES: CCCCCC/C=C\CCCCCCCC(=O)OCC
InChIKey: JELGPLUONQGOHF-KTKRTIGZSA-N
Molecular formula: C18H34O2
Average molar mass: 282.5 g/mol
Monoisotopic mass: 282.25588032

Overview

Ethyl palmitoleate is a long-chain fatty acid ethyl ester resulting from the formal condensation of the carboxy group of palmitoleic acid with the hydroxy group of ethanol. It is functionally related to a palmitoleic acid.

Names & identifiers

Preferred name: Ethyl palmitoleate
IUPAC: ethyl (Z)-hexadec-9-enoate
English name: PALMITOLEIC ACID ETHYL ESTER
Molecular formula: C18H34O2
Molecular weight: 282.46

Names & synonyms

Ethyl palmitoleate56219-10-4PALMITOLEIC ACID ETHYL ESTERVE2016H5BFCHEBI:84934DTXSID201316159RefChem:1085084DTXCID401746023260-065-8Ethyl (Z)-hexadec-9-enoateEthyl cis-9-Hexadecenoateethyl (9Z)-hexadec-9-enoate

Show more names

ETHYL 9-HEXADECENOATEEinecs 260-065-8RARECHEM AL BI 0686Compound T84200(SC)Ethyl cis-palmitoleate9-cis-HEXADECENOIC ETHYL

(Z)-ethyl hexadec-9-enoateethyl 9Z-hexadecenoateMFCD000563149-Hexadecenoic Acid Ethyl Estercis-9-Hexadecenoic Acid Ethyl EsterEthyl (Z)-9-palmitoleateETHYL (Z)-9-HEXADECENOATEWE(2:0/16:1(9Z))

Database identifiers

CAS: 56219-10-4
PubChem CID: 6436624
DTXSID: DTXSID201316159
ChEBI: CHEBI:84934
UNII: VE2016H5BF
EC Number: 260-065-8
Nikkaji: J296.615H

Properties

Computed structural properties

XLogP: 6.9
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 15
Heavy atoms: 20
Formal charge: 0
Complexity: 234

Experimental & physicochemical properties

LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Short fatty esters [FA0710]

Physicochemical properties

Melting point: 33.9 °C · 33.9 °C
Boiling point: 135 °C/1mmHg · 135°C/1mmHg(lit.)
Density: 0.875 · 0.875±0.06 g/cm3(Predicted)
refractive index: 1.447 · 1.4470-1.4490
storage temp.: 20 °C · −20°C
solubility: Chloroform (Slightly), Ethyl Acetate (Slightly)
form: Oil
color: Clear Colorless
LogP: 7.509 · 7.509 (est)
CAS DataBase Reference: 56219 · 56219-10-4
FDA UNII: 2016 H5BF · VE2016H5BF
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
HS Code: 2916.19 · 2916.19.5000

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

hs_code: 2916.19.5000
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P280-P301+P312-P302+P352-P305+P351+P338

Chemistry & industry

Applications

UsesEthyl Palmitoleate is used in biological studies for calcium relase-activated calcium channel blockade as a potential tool in antipancreatitis therapy.

Suppliers64 total

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]

Additional notes

DefinitionChEBI: A long-chain fatty acid ethyl ester resulting from the formal condensation of the carboxy group of palmitoleic acid with the hydroxy group of ethanol.

Related reactions

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Compound notes

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