2-(diphenylphosphorylmethyl)phenol

C19H17O2P — CID 796918

IUPAC2-(diphenylphosphorylmethyl)phenol
SMILESO=P(Cc1ccccc1O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H17O2P/c20-19-14-8-7-9-16(19)15-22(21,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14,20H,15H2
InChIKeyNQWHOPCJTGVYOX-UHFFFAOYSA-N
MW308.32 g/mol
LogP3.91
Rot. Bonds4

About 2-(diphenylphosphorylmethyl)phenol

2-(diphenylphosphorylmethyl)phenol (PubChem CID 796918) has the molecular formula C19H17O2P and a molecular weight of 308.32 g/mol. Its IUPAC name is 2-(diphenylphosphorylmethyl)phenol.

Molecular Properties

Compound Name2-(diphenylphosphorylmethyl)phenol
PubChem CID796918
Molecular FormulaC19H17O2P
Molecular Weight308.32 g/mol
Exact Mass308.10
IUPAC Name2-(diphenylphosphorylmethyl)phenol
SMILESO=P(Cc1ccccc1O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H17O2P/c20-19-14-8-7-9-16(19)15-22(21,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14,20H,15H2
InChIKeyNQWHOPCJTGVYOX-UHFFFAOYSA-N
XLogP3.91
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.32
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 520263
CID 520263
CID 6527
CID 6527
CID 21260
CID 21260
CID 74181
CID 74181
CID 24216
CID 24216
CID 95709
CID 95709
CID 6366969
CID 6366969
CID 63059
CID 63059
CID 75875
CID 75875
CID 75512
CID 75512
CID 92937
CID 92937
CID 77467
CID 77467

Frequently Asked Questions

What is the IUPAC name of 2-(diphenylphosphorylmethyl)phenol?
The IUPAC name of 2-(diphenylphosphorylmethyl)phenol (CID 796918) is 2-(diphenylphosphorylmethyl)phenol.
What is the SMILES notation for 2-(diphenylphosphorylmethyl)phenol?
The canonical SMILES for 2-(diphenylphosphorylmethyl)phenol is O=P(Cc1ccccc1O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(diphenylphosphorylmethyl)phenol?
The InChIKey is NQWHOPCJTGVYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17O2P/c20-19-14-8-7-9-16(19)15-22(21,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14,20H,15H2.
What are the key properties of 2-(diphenylphosphorylmethyl)phenol?
2-(diphenylphosphorylmethyl)phenol has a molecular weight of 308.32 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diphenylphosphorylmethyl)phenol is sourced from PubChem (CID 796918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).