Chem
J-GLOBAL ID:200907017642774611   Nikkaji number:J1.978.277H

(3S,4R)-1-Phenyl-3,4-epoxy-3-(trifluoromethyl)-4-methyl-1-octyne

(3S,4R)-1-フェニル-3,4-エポキシ-3-(トリフルオロメチル)-4-メチル-1-オクチン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C16H17F3O
Molecular formula furigana: C16-H17-F3-O
Molecular weight: 282.306
InChI: InChI=1S/C16H17F3O/c1-3-4-11-14(2)15(20-14,16(17,18)19)12-10-13-8-6-5-7-9-13/h5-9H,3-4,11H2,1-2H3/t14-,15+/m1/s1
InChI key: YNOUDYSEXCVTCL-CABCVRRESA-N
SMILES: CCCC[C@@]1(C)O[C@]1(C#Cc1ccccc1)C(F)(F)F
Systematic name  (3):
  • (3S,4R)-1-フェニル-3,4-エポキシ-3-(トリフルオロメチル)-4-メチル-1-オクチン
  • (2R,3S)-2-ブチル-2-メチル-3-(2-フェニルエチニル)-3-(トリフルオロメチル)オキシラン
  • (2R,3S)-2-butyl-2-methyl-3-(2-phenylethynyl)-3-(trifluoromethyl)oxirane
Other name (1):
  • (3S,4R)-1-Phenyl-3,4-epoxy-3-(trifluoromethyl)-4-methyl-1-octyne
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