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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-, semicarbazone
RN: 101931-81-1
InChIKey: WVCKLEAZQRVDSE-QPSGOUHRSA-N

Molecular Formula

  • C13-H17-F6-N3-O2

Molecular Weight

  • 361.2843
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 101931-81-1

System Generated Number

  • 0101931811

Structure Descriptors

InChI

1S/C13H17F6N3O2/c1-6-4-7(21-22-9(20)23)8(10(2,3)5-6)11(24,12(14,15)16)13(17,18)19/h4,8,24H,5H2,1-3H3,(H3,20,22,23)/b21-7+

InChIKey

WVCKLEAZQRVDSE-QPSGOUHRSA-N

Smiles

CC1=C/C(=N\NC(=O)N)/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 5600ug/kg (5.6mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08241,