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Substance Name: Acrylophenone, 3-chloro-2',4',6'-trimethyl-, (E)-
RN: 41037-46-1
InChIKey: GSQNNWOQBPIEJB-SNAWJCMRSA-N

Molecular Formula

  • C12-H13-Cl-O

Molecular Weight

  • 208.687
 
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Names and Synonyms

Synonyms

  • 2-Propen-1-one, 3-chloro-1-(2,4,6-trimethylphenyl)-, (E)-
  • BRN 2254449
  • trans-3-Chloro-2',4',6'-trimethylacrylophenone

Systematic Name

  • Acrylophenone, 3-chloro-2',4',6'-trimethyl-, (E)-

Registry Numbers

CAS Registry Number

  • 41037-46-1

System Generated Number

  • 0041037461

Structure Descriptors

InChI

1S/C12H13ClO/c1-8-6-9(2)12(10(3)7-8)11(14)4-5-13/h4-7H,1-3H3/b5-4+

InChIKey

GSQNNWOQBPIEJB-SNAWJCMRSA-N

Smiles

c1(c(cc(C)cc1C)C)C(\C=C\Cl)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 44mg/kg (44mg/kg) BEHAVIORAL: TREMOR

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Archives of Toxicology, Supplement. Vol. 4, Pg. 421, 1980.