2,3-Dihydroxypropyl 16-methylheptadecanoate

Base Information

• Chemical Name: 2,3-Dihydroxypropyl 16-methylheptadecanoate
• CAS No.: 66085-00-5
• Deprecated CAS: 32057-14-0
• Molecular Formula: C21H42O4
• Molecular Weight: 358.56
• European Community (EC) Number: 266-124-4,267-822-1,256-603-6
• UNII: HYE7O27HAO
• DSSTox Substance ID: DTXSID70867203
• Nikkaji Number: J261.528B
• Wikidata: Q27280163
• RXCUI: 1311695
• Metabolomics Workbench ID: 105798
• Mol file: 66085-00-5.mol

Synonyms:2,3-Dihydroxypropyl 16-methylheptadecanoate;Glycerol monoisostearate;GLYCERYL ISOSTEARATE;Glyceryl monoisostearate;66085-00-5;2,3-Dihydroxypropyl isooctadecanoate;UNII-HYE7O27HAO;HYE7O27HAO;AKD-2A;Isooctadecanoic acid, monoester with 1,2,3-propanetriol;50486-18-5;67938-24-3;Isostearic acid, 1,2,3-propaneriol ester (1:1);EINECS 256-603-6;EINECS 266-124-4;EINECS 267-822-1;Isooctadecanoic acid, monoester with glycerol;EC 266-124-4;MGIS;NIKKOL MGIS;glycerin monoisostearate;GLYCEROISOSTEARATE;PRISORINE 2040;PRISORINE GMIS 2040;SCHEMBL2516961;DTXSID70867203;GLYCERYL ISOSTEARATE [II];ASKIVFGGGGIGKH-UHFFFAOYSA-N;GLYCERYL ISOSTEARATE [INCI];ISOSTEARIC ACID MONOGLYCERIDE;glycerol monoisostearate, AldrichCPR;2,3-Dihydroxypropyl16-methylheptadecanoate;Q27280163

Chemical Property of 2,3-Dihydroxypropyl 16-methylheptadecanoate

Chemical Property:

• Vapor Pressure: 2.7E-11mmHg at 25°C
• Refractive Index: 1.468
• Boiling Point: 481.5 °C at 760 mmHg
• Flash Point: 153.8 °C
• PSA: 66.76000
• Density: 0.957 g/cm³
• LogP: 5.00020
• XLogP3: 7.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 19
• Exact Mass: 358.30830982
• Heavy Atom Count: 25
• Complexity: 292

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCCCCCCCCCCCCC(=O)OCC(CO)O