Chem
J-GLOBAL ID：200907091373464410   Nikkaji number：J547.676C

3β-[(Z)-2-Chloro-3,3,3-trifluoro-1-propenyl]-2,2-dimethyl-1β-cyclopropanecarboxylic acid 2,3,5,6-tetrafluoro-4-methylbenzyl ester

3β-[(Z)-2-クロロ-3,3,3-トリフルオロ-1-プロペニル]-2,2-ジメチル-1β-シクロプロパンカルボン酸2,3,5,6-テトラフルオロ-4-メチルベンジル
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： C17H14ClF7O2
Molecular formula furigana： C17-H14-CL-F7-O2
Molecular weight： 418.740
InChI： InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-/t8-,10-/m0/s1
InChI key： ZFHGXWPMULPQSE-UKSCLKOJSA-N
SMILES： Cc1c(F)c(F)c(COC(=O)[C@@H]2[C@H](/C=C(\Cl)/C(F)(F)F)C2(C)C)c(F)c1F
Systematic name  (4)：
  • 3β-[(Z)-2-クロロ-3,3,3-トリフルオロ-1-プロペニル]-2,2-ジメチルシクロプロパン-1β-カルボン酸(2,3,5,6-テトラフルオロ-4-メチルフェニル)メチル
  • 3β-[(Z)-2-クロロ-3,3,3-トリフルオロ-1-プロペニル]-2,2-ジメチル-1β-シクロプロパンカルボン酸2,3,5,6-テトラフルオロ-4-メチルベンジル
  • (2,3,5,6-テトラフルオロ-4-メチルフェニル)メチル (1R,3R)-3-[(1Z)-2-クロロ-3,3,3-トリフルオロプロパ-1-エン-1-イル]-2,2-ジメチルシクロプロパン-1-カルボキシラート
  • (2,3,5,6-tetrafluoro-4-methylphenyl)methyl (1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate
Other name (2)：
  • 3β-[(Z)-2-Chloro-3,3,3-trifluoro-1-propenyl]-2,2-dimethyl-1β-cyclopropanecarboxylic acid 2,3,5,6-tetrafluoro-4-methylbenzyl ester
  • 3β-[(Z)-2-Chloro-3,3,3-trifluoro-1-propenyl]-2,2-dimethylcyclopropane-1β-carboxylic acid (2,3,5,6-tetrafluoro-4-methylphenyl)methyl ester
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