Chem
J-GLOBAL ID:201807000378292590   Nikkaji number:J3.687.693J

(E)-2-(Heptafluoropropyl)-3-trifluoromethylsulfonyloxy-3-(4-ethoxycarbonylphenyl)acrylic acid methyl ester

(E)-2-(ヘプタフルオロプロピル)-3-トリフルオロメチルスルホニルオキシ-3-(4-エトキシカルボニルフェニル)アクリル酸メチル
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: C17H12F10O7S
Molecular formula furigana: C17-H12-F10-O7-S
Molecular weight: 550.320
InChI: InChI=1S/C17H12F10O7S/c1-3-33-12(28)9-6-4-8(5-7-9)11(34-35(30,31)17(25,26)27)10(13(29)32-2)14(18,19)15(20,21)16(22,23)24/h4-7H,3H2,1-2H3/b11-10+
InChI key: RBYBEZVPKYPLSR-ZHACJKMWSA-N
SMILES: CCOC(=O)c1ccc(cc1)/C(=C(/C(=O)OC)\C(F)(F)C(F)(F)C(F)(F)F)/OS(=O)(=O)C(F)(F)F
Systematic name  (3):
  • (E)-2-(ヘプタフルオロプロピル)-3-トリフルオロメチルスルホニルオキシ-3-(4-エトキシカルボニルフェニル)アクリル酸メチル
  • エチル 4-[(1E)-2-(1,1,2,2,3,3,3-ヘプタフルオロプロピル)-3-メトキシ-3-オキソ-1-(トリフルオロメタンスルホニルオキシ)プロパ-1-エン-1-イル]ベンゾアート
  • ethyl 4-[(1E)-2-(1,1,2,2,3,3,3-heptafluoropropyl)-3-methoxy-3-oxo-1-(trifluoromethanesulfonyloxy)prop-1-en-1-yl]benzoate
Other name (1):
  • (E)-2-(Heptafluoropropyl)-3-trifluoromethylsulfonyloxy-3-(4-ethoxycarbonylphenyl)acrylic acid methyl ester
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