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Substance Name: Acetanilide, 2',6'-dibromo-
RN: 33098-80-5
InChIKey: PNLHXEUNINMJFM-UHFFFAOYSA-N

Molecular Formula

  • C8-H7-Br2-N-O

Molecular Weight

  • 292.957
 
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Names and Synonyms

Synonyms

  • 0-12-00-00659 (Beilstein Handbook Reference)
  • 2,6-Dibromoacetanilide
  • BRN 1818691

Systematic Name

  • Acetanilide, 2',6'-dibromo-

Registry Numbers

CAS Registry Number

  • 33098-80-5

System Generated Number

  • 0033098805

Structure Descriptors

InChI

1S/C8H7Br2NO/c1-5(12)11-8-6(9)3-2-4-7(8)10/h2-4H,1H3,(H,11,12)

InChIKey

PNLHXEUNINMJFM-UHFFFAOYSA-N

Smiles

c1(c(cccc1Br)Br)NC(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1110mg/kg (1110mg/kg)   Toxicology and Applied Pharmacology. Vol. 19, Pg. 20, 1971.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.53 (none)   EXP
Water Solubility 666 mg/L 25 EST
Vapor Pressure 3.61E-06 mm Hg 25 EST
Henry's Law Constant 9.80E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.12E-12 cm3/molecule-sec 25 EST

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