chloro-(4-phenylphenyl)phosphinic acid

C12H10ClO2P — CID 121303407

IUPACchloro-(4-phenylphenyl)phosphinic acid
SMILESO=P(O)(Cl)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10ClO2P/c13-16(14,15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,14,15)
InChIKeyUHPHGANVEIJZMN-UHFFFAOYSA-N
MW252.64 g/mol
LogP3.40
Rot. Bonds2

About chloro-(4-phenylphenyl)phosphinic acid

chloro-(4-phenylphenyl)phosphinic acid (PubChem CID 121303407) has the molecular formula C12H10ClO2P and a molecular weight of 252.64 g/mol. Its IUPAC name is chloro-(4-phenylphenyl)phosphinic acid.

Molecular Properties

Compound Namechloro-(4-phenylphenyl)phosphinic acid
PubChem CID121303407
Molecular FormulaC12H10ClO2P
Molecular Weight252.64 g/mol
Exact Mass252.01
IUPAC Namechloro-(4-phenylphenyl)phosphinic acid
SMILESO=P(O)(Cl)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10ClO2P/c13-16(14,15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,14,15)
InChIKeyUHPHGANVEIJZMN-UHFFFAOYSA-N
XLogP3.40
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.64
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-(4-phenylphenyl)phosphinic acid?
The IUPAC name of chloro-(4-phenylphenyl)phosphinic acid (CID 121303407) is chloro-(4-phenylphenyl)phosphinic acid.
What is the SMILES notation for chloro-(4-phenylphenyl)phosphinic acid?
The canonical SMILES for chloro-(4-phenylphenyl)phosphinic acid is O=P(O)(Cl)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of chloro-(4-phenylphenyl)phosphinic acid?
The InChIKey is UHPHGANVEIJZMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClO2P/c13-16(14,15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,14,15).
What are the key properties of chloro-(4-phenylphenyl)phosphinic acid?
chloro-(4-phenylphenyl)phosphinic acid has a molecular weight of 252.64 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(4-phenylphenyl)phosphinic acid is sourced from PubChem (CID 121303407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).