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Stearyl oleate

CAT: 0024-sc-215910Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-215910Size:100 mg
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CAS Number
17673-49-3

Chemical Information

Stearyl oleate

Stearyl oleate is a wax ester obtained by the formal condensation of oleic acid with stearyl alcohol. It is functionally related to an oleic acid and an octadecan-1-ol.

CAS Number17673-49-3
PubChem CID5365194
IUPAC Nameoctadecyl (Z)-octadec-9-enoate
Molecular FormulaC36H70O2
Molecular Weight534.9
XLogP16.4
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count33
Heavy Atom Count38
Formal Charge0
Complexity470
SMILES
CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCC/C=C\CCCCCCCC
InChI
InChI=1S/C36H70O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20H,3-17,19,21-35H2,1-2H3/b20-18-
InChIKey
WRPMUZXHQKAAIC-ZZEZOPTASA-N
Chemical Structure
2D Structure
2D structure of Stearyl oleate
CAS: 17673-49-3
CID: 5365194
Formula: C36H70O2
MW: 534.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight534.9
XLogP316.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count33
Exact Mass534.53758147
Monoisotopic Mass534.53758147
Topological Polar Surface Area26.3 Ų
Heavy Atom Count38
Formal Charge0
Complexity470
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes