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Substance Name: 4-Phenylbenzoic acid
RN: 92-92-2
UNII: 36J7VPO67K
InChIKey: NNJMFJSKMRYHSR-UHFFFAOYSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C13-H10-O2

Molecular Weight

  • 198.22
 
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Names and Synonyms

Name of Substance

  • 4-Phenylbenzoic acid

Synonyms

  • 4-09-00-02479 (Beilstein Handbook Reference)
  • 4-Biphenylcarboxylic acid
  • 4-Carboxy-(1,1'-biphenyl)
  • 4-Carboxybiphenyl
  • 4-Diphenylcarboxylic acid
  • 4-Phenylbenzoic acid
  • BRN 0973519
  • EINECS 202-203-1
  • NSC 23040
  • p-Phenylbenzoic acid
  • Para phenyl benzoic acid
  • UNII-36J7VPO67K

Systematic Names

  • (1,1'-Biphenyl)-4-carboxylic acid
  • Biphenyl-4-carboxylic acid

Registry Numbers

CAS Registry Number

  • 92-92-2

FDA UNII

  • 36J7VPO67K

Other Registry Number

  • 92533-42-1

Related Registry Number

  • 62698-50-4 (potassium salt)

System Generated Number

  • 0000092922

Structure Descriptors

InChI

1S/C13H10O2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,14,15)

InChIKey

NNJMFJSKMRYHSR-UHFFFAOYSA-N

Smiles

O=C(O)c1ccc(c2ccccc2)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 228 deg C   EXP
log P (octanol-water) 3.75 (none)   EXP
Water Solubility 28 mg/L 25 EST
Vapor Pressure 5.48E-06 mm Hg 25 EST
Henry's Law Constant 8.33E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.16E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.