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Substance Name: 2,6-Dichloro-4-methylphenol
RN: 2432-12-4
UNII: MIP3UF5E7V
InChIKey: YXEOEPYIBGTLML-UHFFFAOYSA-N

Molecular Formula

  • C7-H6-Cl2-O

Molecular Weight

  • 177.029
 
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Names and Synonyms

Name of Substance

  • 2,6-Dichloro-4-methylphenol

Synonyms

  • 2,6-Dichloro-4-methylphenol
  • 4-Methyl-2,6-dichlorophenol
  • AI3-24009
  • EINECS 219-402-4
  • NSC 407750
  • UNII-MIP3UF5E7V

Systematic Names

  • 2,6-Dichloro-p-cresol
  • p-Cresol, 2,6-dichloro- (8CI)
  • Phenol, 2,6-dichloro-4-methyl-

Registry Numbers

CAS Registry Number

  • 2432-12-4

FDA UNII

  • MIP3UF5E7V

System Generated Number

  • 0002432124

Structure Descriptors

InChI

1S/C7H6Cl2O/c1-4-2-5(8)7(10)6(9)3-4/h2-3,10H,1H3

InChIKey

YXEOEPYIBGTLML-UHFFFAOYSA-N

Smiles

c1(c(cc(C)cc1Cl)Cl)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 39 deg C   EXP
Boiling Point 231 deg C   EXP
pKa Dissociation Constant 7.19 (none) 25 EXP
log P (octanol-water) 3.350 (none)   EST
Water Solubility 6730 mg/L 25 EXP
Vapor Pressure 5.43E-03 mm Hg 25 EST
Henry's Law Constant 3.40E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.01E-12 cm3/molecule-sec 25 EST

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