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Substance Name: 3-Chloro-4-acetotoluidide
RN: 7149-79-3
UNII: X7X7S72D5R
InChIKey: IGLVCWPPISIXPR-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-Cl-N-O

Molecular Weight

  • 183.637
 
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Names and Synonyms

Name of Substance

  • 3-Chloro-4-acetotoluidide

Synonyms

  • 2-12-00-00530 (Beilstein Handbook Reference)
  • 3'-Chloro-p-acetotoluidide
  • 3-Chloro-4-acetotoluidide
  • 4-(Acetylamino)-2-chlorotoluene
  • BRN 2691932
  • DRC-2698
  • EINECS 230-483-5
  • N-(3-Chloro-4-methylphenyl)acetamide
  • NSC 72333
  • o-Chloro-p-acetotoluidide
  • PRC-698
  • UNII-X7X7S72D5R

Systematic Names

  • Acetamide, N-(3-chloro-4-methylphenyl)-
  • N-(3-Chloro-4-methylphenyl)acetamide
  • p-Acetotoluidide, 3'-chloro-

Registry Numbers

CAS Registry Number

  • 7149-79-3

FDA UNII

  • X7X7S72D5R

System Generated Number

  • 0007149793

Structure Descriptors

InChI

1S/C9H10ClNO/c1-6-3-4-8(5-9(6)10)11-7(2)12/h3-5H,1-2H3,(H,11,12)

InChIKey

IGLVCWPPISIXPR-UHFFFAOYSA-N

Smiles

c1(cc(c(C)cc1)Cl)NC(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - wild LD50 oral 1300ug/kg (1.3mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.69 (none)   EXP
Water Solubility 267 mg/L 25 EST
Vapor Pressure 3.66E-05 mm Hg 25 EST
Henry's Law Constant 5.05E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.09E-11 cm3/molecule-sec 25 EST

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