bis(2,2-diphenylacetyl)phosphinic acid

C28H23O4P — CID 159634764

IUPACbis(2,2-diphenylacetyl)phosphinic acid
SMILESO=C(C(c1ccccc1)c1ccccc1)P(=O)(O)C(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H23O4P/c29-27(25(21-13-5-1-6-14-21)22-15-7-2-8-16-22)33(31,32)28(30)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25-26H,(H,31,32)
InChIKeyRFJZLDPTJXQUNV-UHFFFAOYSA-N
MW454.46 g/mol
LogP5.97
Rot. Bonds8

About bis(2,2-diphenylacetyl)phosphinic acid

bis(2,2-diphenylacetyl)phosphinic acid (PubChem CID 159634764) has the molecular formula C28H23O4P and a molecular weight of 454.46 g/mol. Its IUPAC name is bis(2,2-diphenylacetyl)phosphinic acid.

Molecular Properties

Compound Namebis(2,2-diphenylacetyl)phosphinic acid
PubChem CID159634764
Molecular FormulaC28H23O4P
Molecular Weight454.46 g/mol
Exact Mass454.13
IUPAC Namebis(2,2-diphenylacetyl)phosphinic acid
SMILESO=C(C(c1ccccc1)c1ccccc1)P(=O)(O)C(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H23O4P/c29-27(25(21-13-5-1-6-14-21)22-15-7-2-8-16-22)33(31,32)28(30)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25-26H,(H,31,32)
InChIKeyRFJZLDPTJXQUNV-UHFFFAOYSA-N
XLogP5.97
TPSA71.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.46
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,1,5,5-tetraphenylpentane-2,4-dione
CID 22951899
barium(2+);2,2-diphenylacetic acid;hydride
CID 174636718
lithium;2,2-diphenylacetic acid;hydride
CID 174648923
diphenylmethanamine;phosphoric acid
CID 67153031
chloranium 2,2-diphenylacetate
CID 162326731
benzene-1,2-diol;2,2-diphenylacetic acid
CID 70395054
[(1S)-1-phenylethyl]phosphonic acid
CID 10511745
2,2-diphenyl-1-trimethylsilylethanone
CID 15905987
[bromo(phenyl)methyl]phosphonic acid
CID 11736830
dimethylphosphoryl(phenyl)methanol
CID 58658737
N,N-dimethyl-2,2-diphenylacetamide
CID 19693860
[2,2,2-trichloro-1-(2,2-diphenylacetyl)oxyethyl]phosphonic acid
CID 154418136

Frequently Asked Questions

What is the IUPAC name of bis(2,2-diphenylacetyl)phosphinic acid?
The IUPAC name of bis(2,2-diphenylacetyl)phosphinic acid (CID 159634764) is bis(2,2-diphenylacetyl)phosphinic acid.
What is the SMILES notation for bis(2,2-diphenylacetyl)phosphinic acid?
The canonical SMILES for bis(2,2-diphenylacetyl)phosphinic acid is O=C(C(c1ccccc1)c1ccccc1)P(=O)(O)C(=O)C(c1ccccc1)c1ccccc1.
What is the InChIKey of bis(2,2-diphenylacetyl)phosphinic acid?
The InChIKey is RFJZLDPTJXQUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23O4P/c29-27(25(21-13-5-1-6-14-21)22-15-7-2-8-16-22)33(31,32)28(30)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25-26H,(H,31,32).
What are the key properties of bis(2,2-diphenylacetyl)phosphinic acid?
bis(2,2-diphenylacetyl)phosphinic acid has a molecular weight of 454.46 g/mol, XLogP of 5.97, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,2-diphenylacetyl)phosphinic acid is sourced from PubChem (CID 159634764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).