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Substance Name: m-Anisidine
RN: 536-90-3
UNII: JXA144KX2I
InChIKey: NCBZRJODKRCREW-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C7-H9-N-O

Molecular Weight

  • 123.1541
 
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Names and Synonyms

Results Name

  • m-Anisidine

Name of Substance

  • 3-Anisidine
  • m-Anisidine

Synonyms

  • 1-Amino-3-methoxybenzene
  • 3-Aminoanisole
  • 3-Methoxyaniline
  • 3-Methoxybenzenamine
  • 4-13-00-00953 (Beilstein Handbook Reference)
  • AI3-52519
  • BRN 0386119
  • CCRIS 5886
  • EINECS 208-651-4
  • HSDB 7816
  • m-Aminoanisole
  • m-Anisidine
  • m-Anisylamine
  • m-Methoxyaniline
  • NSC 7631
  • UNII-JXA144KX2I

Systematic Names

  • Benzenamine, 3-methoxy-
  • m-Anisidine
  • m-Methoxyaniline

Superlist Name

  • Benzenamine, 3-methoxy-

Registry Numbers

CAS Registry Number

  • 536-90-3

FDA UNII

  • JXA144KX2I

Other Registry Number

  • 918666-97-4

System Generated Number

  • 0000536903

Structure Descriptors

InChI

InChI=1S/C7H9NO/c1-9-7-4-2-3-6(8)5-7/h2-5H,8H2,1H3

InChIKey

NCBZRJODKRCREW-UHFFFAOYSA-N

Smiles

COc1cccc(N)c1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - wild LD50 oral 562mg/kg (562mg/kg)   Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.
quail LD50 oral 562mg/kg (562mg/kg)   Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1 deg C   EXP
Boiling Point 251 deg C   EXP
pKa Dissociation Constant 4.24 (none) 22 EXP
log P (octanol-water) 0.93 (none)   EXP
Water Solubility 1.57E+04 mg/L 25 EST
Vapor Pressure 0.075 mm Hg 25 EXP
Henry's Law Constant 1.13E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.01E-10 cm3/molecule-sec 25 EST

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