triphenyl phosphite

C18H15O3P — CID 7540

IUPACtriphenyl phosphite
SMILESc1ccc(OP(Oc2ccccc2)Oc2ccccc2)cc1
InChIInChI=1S/C18H15O3P/c1-4-10-16(11-5-1)19-22(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18/h1-15H
InChIKeyHVLLSGMXQDNUAL-UHFFFAOYSA-N
MW310.29 g/mol
LogP5.45
Rot. Bonds6

About triphenyl phosphite

triphenyl phosphite (PubChem CID 7540) has the molecular formula C18H15O3P and a molecular weight of 310.29 g/mol. Its IUPAC name is triphenyl phosphite.

Molecular Properties

Compound Nametriphenyl phosphite
PubChem CID7540
Molecular FormulaC18H15O3P
Molecular Weight310.29 g/mol
Exact Mass310.08
IUPAC Nametriphenyl phosphite
SMILESc1ccc(OP(Oc2ccccc2)Oc2ccccc2)cc1
InChIInChI=1S/C18H15O3P/c1-4-10-16(11-5-1)19-22(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18/h1-15H
InChIKeyHVLLSGMXQDNUAL-UHFFFAOYSA-N
XLogP5.45
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.29
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triphenyl phosphite?
The IUPAC name of triphenyl phosphite (CID 7540) is triphenyl phosphite.
What is the SMILES notation for triphenyl phosphite?
The canonical SMILES for triphenyl phosphite is c1ccc(OP(Oc2ccccc2)Oc2ccccc2)cc1.
What is the InChIKey of triphenyl phosphite?
The InChIKey is HVLLSGMXQDNUAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15O3P/c1-4-10-16(11-5-1)19-22(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18/h1-15H.
What are the key properties of triphenyl phosphite?
triphenyl phosphite has a molecular weight of 310.29 g/mol, XLogP of 5.45, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl phosphite is sourced from PubChem (CID 7540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).