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Substance Name: m-Chlorotoluene
RN: 108-41-8
UNII: 5K8172K9TT
InChIKey: OSOUNOBYRMOXQQ-UHFFFAOYSA-N

Molecular Formula

  • C7-H7-Cl

Molecular Weight

  • 126.585
 
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Names and Synonyms

Name of Substance

  • m-Chlorotoluene

Synonyms

  • 1-Chloro-3-methylbenzene
  • 1-Methyl-3-chlorobenzene
  • 3-Chloro-1-methylbenzene
  • 3-Chlorotoluene
  • AI3-26486
  • EINECS 203-580-5
  • m-Chlorotoluene
  • m-Tolyl chloride
  • NSC 8767
  • UNII-5K8172K9TT

Systematic Names

  • 3-Chlorotoluene
  • Benzene, 1-chloro-3-methyl-
  • Toluene, m-chloro- (8CI)

Superlist Names

  • m-Chlorotoluene
  • m-Chlorotoluene [UN2238] [Flammable liquid]
  • UN2238

Registry Numbers

CAS Registry Number

  • 108-41-8

FDA UNII

  • 5K8172K9TT

System Generated Number

  • 0000108418

Structure Descriptors

InChI

1S/C7H7Cl/c1-6-3-2-4-7(8)5-6/h2-5H,1H3

InChIKey

OSOUNOBYRMOXQQ-UHFFFAOYSA-N

Smiles

c1c(cccc1Cl)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -4.78E+01 deg C   EXP
Boiling Point 161.8 deg C   EXP
log P (octanol-water) 3.28 (none)   EXP
Water Solubility 38 mg/L   EXP
Vapor Pressure 3.68 mm Hg 25 EXP
Henry's Law Constant 0.016 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.72E-12 cm3/molecule-sec 25 EST

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