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Substance Name: 2-Butenoic acid, 4,4,4-trifluoro-3-trifluoromethyl-
RN: 1763-28-6
InChIKey: ZSBJCNVMTCMOBW-UHFFFAOYSA-N

Molecular Formula

  • C5-H2-F6-O2

Molecular Weight

  • 208.057
 
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Names and Synonyms

Synonyms

  • 3,3-Bis(trifluoromethyl)-2-propenoic acid
  • 4,4,4-Trifluoro-3-trifluoromethyl-2-butenoic acid
  • BRN 1912186
  • EINECS 217-180-3

Systematic Names

  • 2-Butenoic acid, 4,4,4-trifluoro-3-trifluoromethyl-
  • 4,4,4-Trifluoro-3-(trifluoromethyl)crotonic acid

Registry Numbers

CAS Registry Number

  • 1763-28-6

System Generated Number

  • 0001763286

Structure Descriptors

InChI

1S/C5H2F6O2/c6-4(7,8)2(1-3(12)13)5(9,10)11/h1H,(H,12,13)

InChIKey

ZSBJCNVMTCMOBW-UHFFFAOYSA-N

Smiles

C(\C(C(F)(F)F)=C\C(O)=O)(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#05556,