1-diphenylphosphorylpropan-2-ol

C15H17O2P — CID 2828384

IUPAC1-diphenylphosphorylpropan-2-ol
SMILESCC(O)CP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H17O2P/c1-13(16)12-18(17,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3
InChIKeyRVABRNREAZALPB-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.38
Rot. Bonds4

About 1-diphenylphosphorylpropan-2-ol

1-diphenylphosphorylpropan-2-ol (PubChem CID 2828384) has the molecular formula C15H17O2P and a molecular weight of 260.27 g/mol. Its IUPAC name is 1-diphenylphosphorylpropan-2-ol.

Molecular Properties

Compound Name1-diphenylphosphorylpropan-2-ol
PubChem CID2828384
Molecular FormulaC15H17O2P
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC Name1-diphenylphosphorylpropan-2-ol
SMILESCC(O)CP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H17O2P/c1-13(16)12-18(17,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3
InChIKeyRVABRNREAZALPB-UHFFFAOYSA-N
XLogP2.38
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-diphenylphosphorylpropan-2-ol?
The IUPAC name of 1-diphenylphosphorylpropan-2-ol (CID 2828384) is 1-diphenylphosphorylpropan-2-ol.
What is the SMILES notation for 1-diphenylphosphorylpropan-2-ol?
The canonical SMILES for 1-diphenylphosphorylpropan-2-ol is CC(O)CP(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-diphenylphosphorylpropan-2-ol?
The InChIKey is RVABRNREAZALPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17O2P/c1-13(16)12-18(17,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3.
What are the key properties of 1-diphenylphosphorylpropan-2-ol?
1-diphenylphosphorylpropan-2-ol has a molecular weight of 260.27 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-diphenylphosphorylpropan-2-ol is sourced from PubChem (CID 2828384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).