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Substance Name: 3-Fluoroaniline
RN: 372-19-0
InChIKey: QZVQQUVWFIZUBQ-UHFFFAOYSA-N

Molecular Formula

  • C6-H6-F-N

Molecular Weight

  • 111.118
 
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Names and Synonyms

Name of Substance

  • 3-Fluoroaniline

Synonyms

  • 3-Fluoranilin
  • 3-Fluoranilin [Czech]
  • 3-Fluoroaniline
  • 4-12-00-01101 (Beilstein Handbook Reference)
  • AI3-28559
  • Aniline, 3-fluoro-
  • BRN 1305471
  • EINECS 206-747-0
  • m-Fluoroaniline
  • NSC 10300

Systematic Names

  • 3-Fluoroaniline
  • Aniline, 3-fluoro-
  • Aniline, m-fluoro- (8CI)
  • Benzenamine, 3-fluoro-

Superlist Names

  • m-Fluoroaniline [UN2941] [Keep away from food]
  • UN2941

Registry Numbers

CAS Registry Number

  • 372-19-0

System Generated Number

  • 0000372190

Structure Descriptors

InChI

1S/C6H6FN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2

InChIKey

QZVQQUVWFIZUBQ-UHFFFAOYSA-N

Smiles

c1c(cccc1F)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - wild LD50 oral 56mg/kg (56mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -5.00E+00 deg C   EXP
Boiling Point 188 deg C   EXP
pKa Dissociation Constant 3.5 (none) 25 EXP
log P (octanol-water) 1.3 (none)   EXP
Water Solubility 8370 mg/L 25 EST
Vapor Pressure 1.000 mm Hg 25 EST
Henry's Law Constant 2.22E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.35E-10 cm3/molecule-sec 25 EST

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