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Substance Name: o-Phenylbenzoic acid
RN: 947-84-2
InChIKey: ILYSAKHOYBPSPC-UHFFFAOYSA-N

Molecular Formula

  • C13-H10-O2

Molecular Weight

  • 198.22
 
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Names and Synonyms

Synonym

  • EINECS 213-432-1

Systematic Name

  • o-Phenylbenzoic acid

Registry Numbers

CAS Registry Number

  • 947-84-2

System Generated Number

  • 0000947842

Structure Descriptors

InChI

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

InChIKey

ILYSAKHOYBPSPC-UHFFFAOYSA-N

Smiles

c1ccccc1c1ccccc1C(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 114.3 deg C   EXP
Boiling Point 343.5 deg C   EXP
pKa Dissociation Constant 3.46 (none)   EXP
log P (octanol-water) 2.89 (none)   EXP
Water Solubility 152 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.