Oleate sodiumProduct ingredient for Oleic Acid

Name
Oleate sodium
Drug Entry
Oleic Acid

An unsaturated fatty acid that is the most widely distributed and abundant fatty acid in nature. It is used commercially in the preparation of oleates and lotions, and as a pharmaceutical solvent. (Stedman, 26th ed)

Accession Number
DBSALT001653
Structure
Synonyms
Not Available
UNII
399SL044HN
CAS Number
143-19-1
Weight
Average: 304.4432
Monoisotopic: 304.237824975
Chemical Formula
C18H33NaO2
InChI Key
BCKXLBQYZLBQEK-KVVVOXFISA-M
InChI
InChI=1S/C18H34O2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h9-10H,2-8,11-17H2,1H3,(H,19,20);/q;+1/p-1/b10-9-;
IUPAC Name
sodium (9Z)-octadec-9-enoate
SMILES
[Na+].CCCCCCCC\C=C/CCCCCCCC([O-])=O
KEGG Compound
C18601
ChemSpider
4447502
ChEBI
81860
ChEMBL
CHEMBL3527599
Predicted Properties
PropertyValueSource
Water Solubility2.77e-05 mg/mLALOGPS
logP7.56ALOGPS
logP6.78Chemaxon
logS-7ALOGPS
pKa (Strongest Acidic)4.99Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count2Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area40.13 Å2Chemaxon
Rotatable Bond Count15Chemaxon
Refractivity98.24 m3·mol-1Chemaxon
Polarizability36.6 Å3Chemaxon
Number of Rings0Chemaxon
Bioavailability0Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon