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Substance Name: Benzoic acid, 4-((3-pyridinylcarbonyl)amino)-
RN: 5768-40-1
InChIKey: LWFBUVHQVCTCKN-UHFFFAOYSA-N

Molecular Formula

  • C13-H10-N2-O3

Molecular Weight

  • 242.233
 
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Names and Synonyms

Synonyms

  • p-Nicotinamidobenzoic acid
  • p-Nicotinoylaminobenzoic acid

Systematic Name

  • Benzoic acid, 4-((3-pyridinylcarbonyl)amino)-

Registry Numbers

CAS Registry Number

  • 5768-40-1

System Generated Number

  • 0005768401

Structure Descriptors

InChI

1S/C13H10N2O3/c16-12(10-2-1-7-14-8-10)15-11-5-3-9(4-6-11)13(17)18/h1-8H,(H,15,16)(H,17,18)

InChIKey

LWFBUVHQVCTCKN-UHFFFAOYSA-N

Smiles

O=C(c1cnccc1)Nc1ccc(cc1)C(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.390 (none)   EST
Water Solubility 200 mg/L 25 EXP
Atmospheric OH Rate Constant 5.45E-12 cm3/molecule-sec 25 EST

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