Chem
J-GLOBAL ID:200907049799562102   Nikkaji number:J791.448B

(S)-2,2-Difluoro-7,7-dimethylcycloheptane-1-carboxylic acid ethyl ester

(S)-2,2-ジフルオロ-7,7-ジメチルシクロヘプタン-1-カルボン酸エチル
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: C12H20F2O2
Molecular formula furigana: C12-H20-F2-O2
Molecular weight: 234.287
InChI: InChI=1S/C12H20F2O2/c1-4-16-10(15)9-11(2,3)7-5-6-8-12(9,13)14/h9H,4-8H2,1-3H3/t9-/m1/s1
InChI key: GGPXCHZOCFRKKR-SECBINFHSA-N
SMILES: CCOC(=O)[C@@H]1C(C)(C)CCCCC1(F)F
Systematic name  (3):
  • (S)-2,2-ジフルオロ-7,7-ジメチルシクロヘプタン-1-カルボン酸エチル
  • エチル (1S)-2,2-ジフルオロ-7,7-ジメチルシクロヘプタン-1-カルボキシラート
  • ethyl (1S)-2,2-difluoro-7,7-dimethylcycloheptane-1-carboxylate
Other name (1):
  • (S)-2,2-Difluoro-7,7-dimethylcycloheptane-1-carboxylic acid ethyl ester
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