Chem
J-GLOBAL ID:201707003424184332   Nikkaji number:J3.622.568H

(1S,4R)-4-Ethyl-5,7-dioxabicyclo[2.2.1]heptane-2α-carboxylic acid methyl ester

(1S,4R)-4-エチル-5,7-ジオキサビシクロ[2.2.1]ヘプタン-2α-カルボン酸メチル
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: C9H14O4
Molecular formula furigana: C9-H14-O4
Molecular weight: 186.207
InChI: InChI=1S/C9H14O4/c1-3-9-4-6(8(10)11-2)7(13-9)5-12-9/h6-7H,3-5H2,1-2H3/t6-,7-,9-/m1/s1
InChI key: KNTCIGDRSSCFBC-ZXFLCMHBSA-N
SMILES: CC[C@@]12C[C@H]([C@@H](CO1)O2)C(=O)OC
Systematic name  (3):
  • (1S,4R)-4-エチル-5,7-ジオキサビシクロ[2.2.1]ヘプタン-2α-カルボン酸メチル
  • メチル (1R,4S,5R)-1-エチル-2,7-ジオキサビシクロ[2.2.1]ヘプタン-5-カルボキシラート
  • methyl (1R,4S,5R)-1-ethyl-2,7-dioxabicyclo[2.2.1]heptane-5-carboxylate
Other name (1):
  • (1S,4R)-4-Ethyl-5,7-dioxabicyclo[2.2.1]heptane-2α-carboxylic acid methyl ester
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