(3-hydroxyphenyl) diphenyl phosphate

C18H15O5P — CID 10925911

IUPAC(3-hydroxyphenyl) diphenyl phosphate
SMILESO=P(Oc1ccccc1)(Oc1ccccc1)Oc1cccc(O)c1
InChIInChI=1S/C18H15O5P/c19-15-8-7-13-18(14-15)23-24(20,21-16-9-3-1-4-10-16)22-17-11-5-2-6-12-17/h1-14,19H
InChIKeyAWYVETCHVQGXMB-UHFFFAOYSA-N
MW342.29 g/mol
LogP5.04
Rot. Bonds6

About (3-hydroxyphenyl) diphenyl phosphate

(3-hydroxyphenyl) diphenyl phosphate (PubChem CID 10925911) has the molecular formula C18H15O5P and a molecular weight of 342.29 g/mol. Its IUPAC name is (3-hydroxyphenyl) diphenyl phosphate.

Molecular Properties

Compound Name(3-hydroxyphenyl) diphenyl phosphate
PubChem CID10925911
Molecular FormulaC18H15O5P
Molecular Weight342.29 g/mol
Exact Mass342.07
IUPAC Name(3-hydroxyphenyl) diphenyl phosphate
SMILESO=P(Oc1ccccc1)(Oc1ccccc1)Oc1cccc(O)c1
InChIInChI=1S/C18H15O5P/c19-15-8-7-13-18(14-15)23-24(20,21-16-9-3-1-4-10-16)22-17-11-5-2-6-12-17/h1-14,19H
InChIKeyAWYVETCHVQGXMB-UHFFFAOYSA-N
XLogP5.04
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.29
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3-hydroxyphenyl) diphenyl phosphate?
The IUPAC name of (3-hydroxyphenyl) diphenyl phosphate (CID 10925911) is (3-hydroxyphenyl) diphenyl phosphate.
What is the SMILES notation for (3-hydroxyphenyl) diphenyl phosphate?
The canonical SMILES for (3-hydroxyphenyl) diphenyl phosphate is O=P(Oc1ccccc1)(Oc1ccccc1)Oc1cccc(O)c1.
What is the InChIKey of (3-hydroxyphenyl) diphenyl phosphate?
The InChIKey is AWYVETCHVQGXMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15O5P/c19-15-8-7-13-18(14-15)23-24(20,21-16-9-3-1-4-10-16)22-17-11-5-2-6-12-17/h1-14,19H.
What are the key properties of (3-hydroxyphenyl) diphenyl phosphate?
(3-hydroxyphenyl) diphenyl phosphate has a molecular weight of 342.29 g/mol, XLogP of 5.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-hydroxyphenyl) diphenyl phosphate is sourced from PubChem (CID 10925911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).