[2-(4-phenylphenyl)phenyl]phosphonic acid

C18H15O3P — CID 175600433

IUPAC[2-(4-phenylphenyl)phenyl]phosphonic acid
SMILESO=P(O)(O)c1ccccc1-c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H15O3P/c19-22(20,21)18-9-5-4-8-17(18)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H,(H2,19,20,21)
InChIKeyVPNPYMCHVBVCHN-UHFFFAOYSA-N
MW310.29 g/mol
LogP3.82
Rot. Bonds3

About [2-(4-phenylphenyl)phenyl]phosphonic acid

[2-(4-phenylphenyl)phenyl]phosphonic acid (PubChem CID 175600433) has the molecular formula C18H15O3P and a molecular weight of 310.29 g/mol. Its IUPAC name is [2-(4-phenylphenyl)phenyl]phosphonic acid.

Molecular Properties

Compound Name[2-(4-phenylphenyl)phenyl]phosphonic acid
PubChem CID175600433
Molecular FormulaC18H15O3P
Molecular Weight310.29 g/mol
Exact Mass310.08
IUPAC Name[2-(4-phenylphenyl)phenyl]phosphonic acid
SMILESO=P(O)(O)c1ccccc1-c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H15O3P/c19-22(20,21)18-9-5-4-8-17(18)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H,(H2,19,20,21)
InChIKeyVPNPYMCHVBVCHN-UHFFFAOYSA-N
XLogP3.82
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.29
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-[methyl(phenyl)phosphoryl]-2-phenylbenzene
CID 44633937
1-methyl-4-(2-phenylphenyl)benzene;phosphoric acid
CID 67896941
phenylmethoxy-(2-phenylphenyl)phosphinic acid
CID 139679821
1-methyl-2-phenylbenzene;phosphoric acid
CID 159087333
1-phenyl-2-[phenyl-[2-[phenyl-(2-phenylphenyl)phosphoryl]ethyl]phosphoryl]benzene
CID 44634324
chloro-(4-phenylphenyl)phosphinic acid
CID 121303407
1-[azido(phenyl)phosphoryl]-2-phenylbenzene
CID 152548936
1-[ethyl-(4-phenylphenyl)phosphoryl]-2-[2-[ethyl-(4-phenylphenyl)phosphoryl]phenyl]benzene
CID 59426989
(2-phenylphenyl) dihydrogen phosphate
CID 19371408
[difluoro-[4-[[4-(4-phenyl-3-phosphonophenyl)phenyl]methylsulfanylmethyl]phenyl]methyl]phosphonic acid
CID 10281621
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
sodium;hydride;2-phenylphenol;4-phenylphenol
CID 173165495

Frequently Asked Questions

What is the IUPAC name of [2-(4-phenylphenyl)phenyl]phosphonic acid?
The IUPAC name of [2-(4-phenylphenyl)phenyl]phosphonic acid (CID 175600433) is [2-(4-phenylphenyl)phenyl]phosphonic acid.
What is the SMILES notation for [2-(4-phenylphenyl)phenyl]phosphonic acid?
The canonical SMILES for [2-(4-phenylphenyl)phenyl]phosphonic acid is O=P(O)(O)c1ccccc1-c1ccc(-c2ccccc2)cc1.
What is the InChIKey of [2-(4-phenylphenyl)phenyl]phosphonic acid?
The InChIKey is VPNPYMCHVBVCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15O3P/c19-22(20,21)18-9-5-4-8-17(18)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H,(H2,19,20,21).
What are the key properties of [2-(4-phenylphenyl)phenyl]phosphonic acid?
[2-(4-phenylphenyl)phenyl]phosphonic acid has a molecular weight of 310.29 g/mol, XLogP of 3.82, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-phenylphenyl)phenyl]phosphonic acid is sourced from PubChem (CID 175600433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).