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Substance Name: 5-Heptene-2,4-diol, 6-methyl-1,1,1-trifluoro-2-(trifluoromethyl)-
RN: 34844-50-3
InChIKey: RQLUTZGKUKGXRM-UHFFFAOYSA-N

Molecular Formula

  • C9-H12-F6-O2

Molecular Weight

  • 266.18
 
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Names and Synonyms

Synonyms

  • 6-Methyl-1,1,1-trifluoro-2-trifluoromethyl-5-heptene-2,4-diol
  • BRN 2274946
  • NSC 159949

Systematic Name

  • 5-Heptene-2,4-diol, 6-methyl-1,1,1-trifluoro-2-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 34844-50-3

System Generated Number

  • 0034844503

Structure Descriptors

InChI

1S/C9H12F6O2/c1-5(2)3-6(16)4-7(17,8(10,11)12)9(13,14)15/h3,6,16-17H,4H2,1-2H3

InChIKey

RQLUTZGKUKGXRM-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 75mg/kg (75mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08277,