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Substance Name: 2-Chloro-4-methylphenol
RN: 6640-27-3
UNII: 1J012K1LJC
InChIKey: AQJFATAFTQCRGC-UHFFFAOYSA-N

Molecular Formula

  • C7-H7-Cl-O

Molecular Weight

  • 142.5843
 
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Names and Synonyms

Name of Substance

  • 2-Chloro-4-methylphenol

Synonyms

  • 2-Chloro-4-methylphenol
  • 2-Chloro-p-cresol
  • EINECS 229-656-8
  • NSC 48848
  • UNII-1J012K1LJC

Systematic Names

  • 2-Chloro-p-cresol
  • p-Cresol, 2-chloro- (8CI)
  • Phenol, 2-chloro-4-methyl-

Registry Numbers

CAS Registry Number

  • 6640-27-3

FDA UNII

  • 1J012K1LJC

System Generated Number

  • 0006640273

Structure Descriptors

InChI

1S/C7H7ClO/c1-5-2-3-7(9)6(8)4-5/h2-4,9H,1H3

InChIKey

AQJFATAFTQCRGC-UHFFFAOYSA-N

Smiles

Cc1ccc(c(c1)Cl)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 195.5 deg C   EXP
pKa Dissociation Constant 8.74 (none) 20 EXP
log P (octanol-water) 2.700 (none)   EST
Water Solubility 1520 mg/L 25 EST
Vapor Pressure 0.041 mm Hg 25 EST
Henry's Law Constant 4.58E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.22E-11 cm3/molecule-sec 25 EST

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