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Substance Name: Cinnamyl alcohol, 1-(2-hydroxy-2-bis(trifluoromethyl))ethyl-
RN: 34848-37-8
InChIKey: RQOACHKKGFEMHR-VOTSOKGWSA-N

Molecular Formula

  • C13-H12-F6-O2

Molecular Weight

  • 314.224
 
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Names and Synonyms

Synonyms

  • 5-Hexene-2,4-diol, 6-phenyl-1,1,1-trifluoro-2-trifluoromethyl-
  • 6-Phenyl-1,1,1-trifluoro-2-trifluoromethyl-5-hexene-2,4-diol
  • BRN 1997448
  • NSC 162230

Systematic Name

  • Cinnamyl alcohol, 1-(2-hydroxy-2-bis(trifluoromethyl))ethyl-

Registry Numbers

CAS Registry Number

  • 34848-37-8

System Generated Number

  • 0034848378

Structure Descriptors

InChI

1S/C13H12F6O2/c14-12(15,16)11(21,13(17,18)19)8-10(20)7-6-9-4-2-1-3-5-9/h1-7,10,20-21H,8H2/b7-6+

InChIKey

RQOACHKKGFEMHR-VOTSOKGWSA-N

Smiles

C(C[C@@H](\C=C\c1ccccc1)O)(C(F)(F)F)(C(F)(F)F)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08983,