Sorbitol 6-monooleate

Base Information

• Chemical Name: Sorbitol 6-monooleate
• CAS No.: 1333-68-2
• Deprecated CAS: 112964-28-0
• Molecular Formula: C24H46O7
• Molecular Weight: 446.61784
• European Community (EC) Number: 215-602-0
• UNII: L4642F39YQ
• Wikidata: Q4428993
• RXCUI: 1812934
• Mol file: 1333-68-2.mol

Synonyms:Sorbitol 6-monooleate;Sorbitol 6-oleate;D-Glucitol 6-oleate;D-Glucitol monooleate;sorbitol monooleate;D-Glucitol, 6-(9Z)-9-octadecenoate;UNII-L4642F39YQ;D-Glucitol, 6-(9-octadecenoate), (Z)-;L4642F39YQ;1333-68-2;D-Glucitol, mono-9-octadecenoate, (Z)-;UNII-658271J00C;EINECS 215-602-0;143615-26-3;D-Glucitol, mono-(9Z)-9-octadecenoate;[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl] (Z)-octadec-9-enoate;Glucitol, monooleate;SCHEMBL41613;658271J00C;Q4428993

Chemical Property of Sorbitol 6-monooleate

Chemical Property:

• Vapor Pressure: 3.41E-18mmHg at 25°C
• Boiling Point: 624.1°Cat760mmHg
• Flash Point: 200.7°C
• PSA: 127.45000
• Density: 1.087g/cm³
• LogP: 3.00300
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 22
• Exact Mass: 446.32435380
• Heavy Atom Count: 31
• Complexity: 442

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(C(C(C(CO)O)O)O)O
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O