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Substance Name: Crotonophenone, 4,4,4-trifluoro-3-(trifluoromethyl)-3',4',5'-trimethoxy-
RN: 35443-96-0
InChIKey: NMQKOYCTFZZJEN-UHFFFAOYSA-N

Molecular Formula

  • C14-H12-F6-O4

Molecular Weight

  • 358.233
 
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Names and Synonyms

Synonyms

  • 4,4,4-Trifluoro-3-trifluoromethyl-1-(3,4,5-trimethoxyphenyl)-2-buten-1-one
  • 4,4,4-Trifluoro-3-trifluoromethyl-3',4',5'-trimethoxycrotonophenone
  • BRN 2305734
  • NSC 162064

Systematic Name

  • Crotonophenone, 4,4,4-trifluoro-3-(trifluoromethyl)-3',4',5'-trimethoxy-

Registry Numbers

CAS Registry Number

  • 35443-96-0

System Generated Number

  • 0035443960

Structure Descriptors

InChI

1S/C14H12F6O4/c1-22-9-4-7(5-10(23-2)12(9)24-3)8(21)6-11(13(15,16)17)14(18,19)20/h4-6H,1-3H3

InChIKey

NMQKOYCTFZZJEN-UHFFFAOYSA-N

Smiles

c1(cc(c(OC)c(c1)OC)OC)C(\C=C(/C(F)(F)F)C(F)(F)F)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 24mg/kg (24mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08752,