Diphenic acid

C14H10O4CAS 482-05-3242.23 g/mol

Open in Covalent MOL file
OHOOOH
Carboxylic acid

Properties

Molecular formula
C14H10O4
Molar mass
242.23 g/mol
Exact mass
242.0579 Da
Melting point
233.5 °C
logP
2.75Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
482-05-3
SMILES
O=C(O)c1ccccc1-c1ccccc1C(=O)O
InChIKey
GWZCCUDJHOGOSO-UHFFFAOYSA-N
InChI
InChI=1S/C14H10O4/c15-13(16)11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(17)18/h1-8H,(H,15,16)(H,17,18)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names
  • [1,1′-Biphenyl]-2,2′-dicarboxylic acid
  • o,o′-Bibenzoic acid
  • 2,2′-Biphenyldicarboxylic acid
  • 2,2′-Bibenzoic acid
  • o,o′-Diphenic acid
  • 2,2′-Dicarboxybiphenyl
  • 2,2′-Diphenic acid
  • Diphenyl-2,2′-dicarboxylic acid
  • 2′-Carboxybiphenyl-2-carboxylic acid
  • NSC 1966
  • 2-(2-Carboxyphenyl)benzoic acid

Reactions

Work with Diphenic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Phthalic acid88-99-376 % similar 1-Biphenyl-2-carboxylic acid947-84-276 % similar Ammonium phthalate523-24-067 % similar 9-Oxo-9H-fluorenecarboxylic acid1573-92-866 % similar 4′-Fluoro[1,1′-biphenyl]-2-carboxylic acid1841-57-263 % similar 4'-Chloro-biphenyl-2-carboxylic acid7079-15-463 % similar 4′-Methyl[1,1′-biphenyl]-2-carboxylic acid7148-03-063 % similar Salicylic acid69-72-762 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Anthracene-1,4,9,10-tetraol476-60-8 [1,1′-Biphenyl]-4,4′-dicarboxylic acid787-70-2 2-(4-Hydroxybenzoyl)benzoic acid85-57-4 Benzoyl peroxide94-36-0

Elsewhere

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