Chem
J-GLOBAL ID：200907077387544146   Nikkaji number：J1.978.282D

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

(3R,4R)-1-フェニル-3,4-エポキシ-3-(トリフルオロメチル)-4-(ヒドロキシジフェニルメチル)-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： C28H25F3O2
Molecular formula furigana： C28-H25-F3-O2
Molecular weight： 450.501
InChI： InChI=1S/C28H25F3O2/c1-2-3-20-25(26(33-25,28(29,30)31)21-19-22-13-7-4-8-14-22)27(32,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,32H,2-3,20H2,1H3/t25-,26+/m0/s1
InChI key： YGHWRKCKPKJGBY-IZZNHLLZSA-N
SMILES： CCCC[C@@]1(O[C@@]1(C#Cc1ccccc1)C(F)(F)F)C(O)(c1ccccc1)c1ccccc1
Systematic name  (3)：
  • (3R,4R)-1-フェニル-3,4-エポキシ-3-(トリフルオロメチル)-4-(ヒドロキシジフェニルメチル)-1-オクチン
  • [(2R,3R)-2-ブチル-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-2-イル]ジフェニルメタノール
  • [(2R,3R)-2-butyl-3-(2-phenylethynyl)-3-(trifluoromethyl)oxiran-2-yl]diphenylmethanol
Other name (1)：
  • (3R,4R)-1-Phenyl-3,4-epoxy-3-(trifluoromethyl)-4-(hydroxydiphenylmethyl)-1-octyne
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