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Triphenyl Phosphate 99% Extrapure

CAT: 1507-02777 00500Size: 500 mgDry Ice: NoHazardous: No
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CAT#:1507-02777 00500Size:500 mg
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CAS Number
115-86-6

Chemical Information

Triphenyl Phosphate

Triphenyl phosphate is an aryl phosphate resulting from the formal condensation of phosphoric acid with 3 mol eq. of phenol. It has a role as a plasticiser and a flame retardant. It is functionally related to a phenol.

CAS Number115-86-6
PubChem CID8289
IUPAC Nametriphenyl phosphate
Molecular FormulaC18H15O4P
Molecular Weight326.3
XLogP4.6
Topological Polar Surface Area44.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count23
Formal Charge0
Complexity325
SMILES
C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3
InChI
InChI=1S/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H
InChIKey
XZZNDPSIHUTMOC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Triphenyl Phosphate
CAS: 115-86-6
CID: 8289
Formula: C18H15O4P
MW: 326.3
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight326.3
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass326.07079595
Monoisotopic Mass326.07079595
Topological Polar Surface Area44.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity325
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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