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Substance Name: 4-Azidobenzoic acid
RN: 6427-66-3
InChIKey: PQXPAFTXDVNANI-UHFFFAOYSA-N

Molecular Formula

  • C7-H5-N3-O2

Molecular Weight

  • 163.135
 
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Names and Synonyms

Name of Substance

  • 4-Azidobenzoic acid

Synonym

  • EINECS 229-198-9

Systematic Name

  • 4-Azidobenzoic acid

Registry Numbers

CAS Registry Number

  • 6427-66-3

System Generated Number

  • 0006427663

Structure Descriptors

InChI

1S/C7H5N3O2/c8-10-9-6-3-1-5(2-4-6)7(11)12/h1-4H,(H,11,12)

InChIKey

PQXPAFTXDVNANI-UHFFFAOYSA-N

Smiles

[N+](=[N-])=Nc1ccc(C(=O)O)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.54 (none)   EXP
Water Solubility 166 mg/L 25 EST
Vapor Pressure 9.21E-10 mm Hg 25 EST
Henry's Law Constant 8.18E-15 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.31E-13 cm3/molecule-sec 25 EST

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