(4-hydroxyphenyl) diphenyl phosphate

C18H15O5P — CID 57058026

IUPAC(4-hydroxyphenyl) diphenyl phosphate
SMILESO=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccc(O)cc1
InChIInChI=1S/C18H15O5P/c19-15-11-13-18(14-12-15)23-24(20,21-16-7-3-1-4-8-16)22-17-9-5-2-6-10-17/h1-14,19H
InChIKeyNOPNBQOZUKISRP-UHFFFAOYSA-N
MW342.29 g/mol
LogP5.04
Rot. Bonds6

About (4-hydroxyphenyl) diphenyl phosphate

(4-hydroxyphenyl) diphenyl phosphate (PubChem CID 57058026) has the molecular formula C18H15O5P and a molecular weight of 342.29 g/mol. Its IUPAC name is (4-hydroxyphenyl) diphenyl phosphate.

Molecular Properties

Compound Name(4-hydroxyphenyl) diphenyl phosphate
PubChem CID57058026
Molecular FormulaC18H15O5P
Molecular Weight342.29 g/mol
Exact Mass342.07
IUPAC Name(4-hydroxyphenyl) diphenyl phosphate
SMILESO=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccc(O)cc1
InChIInChI=1S/C18H15O5P/c19-15-11-13-18(14-12-15)23-24(20,21-16-7-3-1-4-8-16)22-17-9-5-2-6-10-17/h1-14,19H
InChIKeyNOPNBQOZUKISRP-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 (4-hydroxyphenyl) diphenyl phosphate?
The IUPAC name of (4-hydroxyphenyl) diphenyl phosphate (CID 57058026) is (4-hydroxyphenyl) diphenyl phosphate.
What is the SMILES notation for (4-hydroxyphenyl) diphenyl phosphate?
The canonical SMILES for (4-hydroxyphenyl) diphenyl phosphate is O=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccc(O)cc1.
What is the InChIKey of (4-hydroxyphenyl) diphenyl phosphate?
The InChIKey is NOPNBQOZUKISRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15O5P/c19-15-11-13-18(14-12-15)23-24(20,21-16-7-3-1-4-8-16)22-17-9-5-2-6-10-17/h1-14,19H.
What are the key properties of (4-hydroxyphenyl) diphenyl phosphate?
(4-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 (4-hydroxyphenyl) diphenyl phosphate is sourced from PubChem (CID 57058026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).