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Substance Name: 2-Cyclohexen-1-one, 6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-3,5,5-trimethyl-
RN: 101564-50-5
InChIKey: NGQSHSNHDAUHIQ-UHFFFAOYSA-N

Molecular Formula

  • C12-H14-F6-O2

Molecular Weight

  • 304.2286
 
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Names and Synonyms

Synonyms

  • 6-(1,1,1,3,3,3-Hexafluoro-2-hydroxy-2-propyl)-3,5,5-trimethyl-2-cyclohexen-1-one
  • 6-(2,2,2-Trifluoro-1-hydroxy-1-trifluoromethyl)ethyl-3,5,5-trimethyl-2-cyclohexen-1-one

Systematic Name

  • 2-Cyclohexen-1-one, 6-(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-3,5,5-trimethyl-

Registry Numbers

CAS Registry Number

  • 101564-50-5

System Generated Number

  • 0101564505

Structure Descriptors

InChI

1S/C12H14F6O2/c1-6-4-7(19)8(9(2,3)5-6)10(20,11(13,14)15)12(16,17)18/h4,8,20H,5H2,1-3H3

InChIKey

NGQSHSNHDAUHIQ-UHFFFAOYSA-N

Smiles

CC1=CC(=O)C(C(C1)(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 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08180,