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Oleyl Phosphate (Mono- and Di- Ester mixture)

CAT: 0127-OR1078298-01Size: 25 mLDry Ice: NoHazardous: No
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CAT#:0127-OR1078298-01Size:25 mL
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CAS Number
37310-83-1
Synonyms
Phosphoric Acid Oleyl Ester
MDL Number
MFCD00135103
Purity
≥95%
Smiles
CCCCCCCCC=CCCCCCCCCO.OP (=O) (O) O

Chemical Information

Oleyl Phosphate

The CIR Expert Panel concluded the following 28 alkyl phosphates are safe in the present practices of use and concentration in cosmetics when formulated to be non-irritating...Oleyl Phosphate...

CAS Number37310-83-1
PubChem CID6435865
IUPAC Name(Z)-octadec-9-en-1-ol;phosphoric acid
Molecular FormulaC18H39O5P
Molecular Weight366.5
Topological Polar Surface Area98
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count15
Heavy Atom Count24
Formal Charge0
Complexity224
SMILES
CCCCCCCC/C=C\CCCCCCCCO.OP(=O)(O)O
InChI
InChI=1S/C18H36O.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;1-5(2,3)4/h9-10,19H,2-8,11-18H2,1H3;(H3,1,2,3,4)/b10-9-;
InChIKey
JGVOASSDYQIBIF-KVVVOXFISA-N
Chemical Structure
2D Structure
2D structure of Oleyl Phosphate
CAS: 37310-83-1
CID: 6435865
Formula: C18H39O5P
MW: 366.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight366.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count15
Exact Mass366.25351134
Monoisotopic Mass366.25351134
Topological Polar Surface Area98 Ų
Heavy Atom Count24
Formal Charge0
Complexity224
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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