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Substance Name: 2,4,6-Trichloro-m-cresol
RN: 551-76-8
UNII: D0H0QF5KL9
InChIKey: QTAATZDGGZYBDC-UHFFFAOYSA-N

Molecular Formula

  • C7-H5-Cl3-O

Molecular Weight

  • 211.475
 
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Names and Synonyms

Name of Substance

  • 2,4,6-Trichloro-m-cresol

Synonyms

  • 2,4,6-Trichloro-3-methylphenol
  • UNII-D0H0QF5KL9

Systematic Name

  • Phenol, 2,4,6-trichloro-3-methyl-

Registry Numbers

CAS Registry Number

  • 551-76-8

FDA UNII

  • D0H0QF5KL9

System Generated Number

  • 0000551768

Structure Descriptors

InChI

1S/C7H5Cl3O/c1-3-4(8)2-5(9)7(11)6(3)10/h2,11H,1H3

InChIKey

QTAATZDGGZYBDC-UHFFFAOYSA-N

Smiles

c1(c(c(cc(c1O)Cl)Cl)C)Cl

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 46 deg C   EXP
Boiling Point 265 deg C   EXP
log P (octanol-water) 3.990 (none)   EST
Water Solubility 112 mg/L 25 EXP
Vapor Pressure 7.20E-04 mm Hg 25 EST
Henry's Law Constant 2.52E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.49E-13 cm3/molecule-sec 25 EST

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