Chem
J-GLOBAL ID:200907054860271284   Nikkaji number:J2.772.769G

(1α,4α)-5β,6β-Epoxy-7-oxabicyclo[2.2.1]heptane-2β-carboxylic acid 2,2,2-trifluoroethyl ester

(1α,4α)-5β,6β-エポキシ-7-オキサビシクロ[2.2.1]ヘプタン-2β-カルボン酸2,2,2-トリフルオロエチル
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: C9H9F3O4
Molecular formula furigana: C9-H9-F3-O4
Molecular weight: 238.162
InChI: InChI=1S/C9H9F3O4/c10-9(11,12)2-14-8(13)3-1-4-6-7(16-6)5(3)15-4/h3-7H,1-2H2/t3-,4-,5+,6+,7-/m0/s1
InChI key: GVDLFSSJOJDPFG-TYDWOXHJSA-N
SMILES: FC(F)(F)COC(=O)[C@H]1C[C@@H]2O[C@H]1[C@@H]1O[C@H]21
Systematic name  (3):
  • (1α,4α)-5β,6β-エポキシ-7-オキサビシクロ[2.2.1]ヘプタン-2β-カルボン酸2,2,2-トリフルオロエチル
  • 2,2,2-トリフルオロエチル (1S,2R,4S,5R,6S)-3,8-ジオキサトリシクロ[3.2.1.02,4]オクタン-6-カルボキシラート
  • 2,2,2-trifluoroethyl (1S,2R,4S,5R,6S)-3,8-dioxatricyclo[3.2.1.02,4]octane-6-carboxylate
Other name (1):
  • (1α,4α)-5β,6β-Epoxy-7-oxabicyclo[2.2.1]heptane-2β-carboxylic acid 2,2,2-trifluoroethyl ester
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