[(1R)-1-[(2S,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] 16-methylheptadecanoate

Base Information

• Chemical Name: [(1R)-1-[(2S,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] 16-methylheptadecanoate
• CAS No.: 54392-26-6
• Molecular Formula: C24H46O6
• Molecular Weight: 430.61844
• Hs Code.: 2932190090
• European Community (EC) Number: 611-132-9
• DSSTox Substance ID: DTXSID90969511
• Wikidata: Q76728089
• Mol file: 54392-26-6.mol

Synonyms:54392-26-6;[(1R)-1-[(2S,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] 16-methylheptadecanoate;(R)-1-((2S,3R,4S)-3,4-dihydroxytetrahydrofuran-2-yl)-2-hydroxyethyl 16-methylheptadecanoate;sorbitanisostearate;Sorbitan,isooctadecanoate;SCHEMBL15578308;DTXSID90969511;1,4-Anhydro-5-O-(16-methylheptadecanoyl)hexitol;(1R)-1-[(2S,3R,4S)-3,4-DIHYDROXYOXOLAN-2-YL]-2-HYDROXYETHYL 16-METHYLHEPTADECANOATE

Chemical Property of [(1R)-1-[(2S,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] 16-methylheptadecanoate

Chemical Property:

• PSA: 96.22000
• LogP: 4.12850
• Storage Temp.: 2-8°C
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 19
• Exact Mass: 430.32943918
• Heavy Atom Count: 30
• Complexity: 428

Purity/Quality:

99% ^*data from raw suppliers

Sorbitanisostearate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCCCCCCCCCCCCC(=O)OC(CO)C1C(C(CO1)O)O
• Isomeric SMILES: CC(C)CCCCCCCCCCCCCCC(=O)O[C@H](CO)[C@@H]1[C@@H]([C@H](CO1)O)O
• Uses: sorbitan isostearate is an emulsifier used in the preparation of sunscreens, moisturizing creams, and lotions.