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(S) -2,3-Dihydroxypropyl Stearate

CAT: 1299-RG-D090813-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-D090813-01Size:10 mg
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CAS Number
22610-61-3
Synonyms
(S) -2,3-dihydroxypropyl stearate
Molecular Formula
C21H42O4
Molecular Weight
358.56
Product Name Synonym
(S) -2,3-dihydroxypropyl stearate

Chemical Information

1-Stearoyl-sn-glycerol

1-stearoyl-sn-glycerol is a 1-acyl-sn-glycerol that has octadecanoyl (stearoyl) as the 1-acyl group. It has a role as a plant metabolite. It is a 1-acyl-sn-glycerol and a 1-monostearoylglycerol. It is an enantiomer of a 3-stearoyl-sn-glycerol.

CAS Number22610-61-3
PubChem CID15560610
IUPAC Name[(2S)-2,3-dihydroxypropyl] octadecanoate
Molecular FormulaC21H42O4
Molecular Weight358.6
XLogP7.4
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count20
Heavy Atom Count25
Formal Charge0
Complexity281
SMILES
CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO)O
InChI
InChI=1S/C21H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h20,22-23H,2-19H2,1H3/t20-/m0/s1
InChIKey
VBICKXHEKHSIBG-FQEVSTJZSA-N
Chemical Structure
2D Structure
2D structure of 1-Stearoyl-sn-glycerol
CAS: 22610-61-3
CID: 15560610
Formula: C21H42O4
MW: 358.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight358.6
XLogP37.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count20
Exact Mass358.30830982
Monoisotopic Mass358.30830982
Topological Polar Surface Area66.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity281
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
FE142355-012-Ethylhexyl stearate
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OR1051117-012-Chloroethyl stearate
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