Chem
J-GLOBAL ID：200907045322848254
Nikkaji number：J631.972F
2-Oxocycloheptanecarboxylic acid methyl ester
2-オキソシクロヘプタンカルボン酸メチル
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
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
Molecular formula： C9H14O3
Molecular formula furigana： C9-H14-O3
Molecular weight： 170.208
InChI：
InChI=1S/C9H14O3/c1-12-9(11)7-5-3-2-4-6-8(7)10/h7H,2-6H2,1H3
InChI key：
BLNHITXSJKCQGZ-UHFFFAOYSA-N
SMILES：
COC(=O)C1CCCCCC1=O
Systematic name (5)：
- 2-オキソシクロヘプタンカルボン酸メチル
- 2-オキソシクロヘプタン-1-カルボン酸メチル
- 2-オキソ-1-シクロヘプタンカルボン酸メチル
- メチル 2-オキソシクロヘプタン-1-カルボキシラート
- methyl 2-oxocycloheptane-1-carboxylate
- 2-Oxocycloheptanecarboxylic acid methyl ester
- 2-Oxocycloheptane-1-carboxylic acid methyl ester
- 2-Oxo-1-cycloheptanecarboxylic acid methyl ester
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