Chem
J-GLOBAL ID：200907066447545447
Nikkaji number：J1.042.150K
7-Hydroxy-1,3-benzodioxole-5-carboxylic acid methyl ester
7-ヒドロキシ-1,3-ベンゾジオキソール-5-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： C9H8O5
Molecular formula furigana： C9-H8-O5
Molecular weight： 196.158
InChI：
InChI=1S/C9H8O5/c1-12-9(11)5-2-6(10)8-7(3-5)13-4-14-8/h2-3,10H,4H2,1H3
InChI key：
ZHGPEDRDUUKPCF-UHFFFAOYSA-N
SMILES：
COC(=O)c1cc2OCOc2c(O)c1
Systematic name (3)：
- 7-ヒドロキシ-1,3-ベンゾジオキソール-5-カルボン酸メチル
- メチル 7-ヒドロキシ-2H-1,3-ベンゾジオキソール-5-カルボキシラート
- methyl 7-hydroxy-2H-1,3-benzodioxole-5-carboxylate
- 7-Hydroxy-1,3-benzodioxole-5-carboxylic acid methyl ester
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