Chem
J-GLOBAL ID：200907003886556437
Nikkaji number：J995.260H
α-Chloro-β-oxofuran-2-propionic acid methyl ester
α-クロロ-β-オキソフラン-2-プロピオン酸メチル
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： C8H7ClO4
Molecular formula furigana： C8-H7-CL-O4
Molecular weight： 202.590
InChI：
InChI=1S/C8H7ClO4/c1-12-8(11)6(9)7(10)5-3-2-4-13-5/h2-4,6H,1H3
InChI key：
XBNUUBPAUYZCIF-UHFFFAOYSA-N
SMILES：
COC(=O)C(Cl)C(=O)c1ccco1
Systematic name (3)：
- α-クロロ-β-オキソフラン-2-プロピオン酸メチル
- メチル 2-クロロ-3-(フラン-2-イル)-3-オキソプロパノアート
- methyl 2-chloro-3-(furan-2-yl)-3-oxopropanoate
- α-Chloro-β-oxofuran-2-propionic acid methyl ester
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