Chem
J-GLOBAL ID：200907058941054437
Nikkaji number：J1.404.464G
5-Ethynylisophthalic acid
5-エチニルイソフタル酸
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： C10H6O4
Molecular formula furigana： C10-H6-O4
Molecular weight： 190.154
InChI：
InChI=1S/C10H6O4/c1-2-6-3-7(9(11)12)5-8(4-6)10(13)14/h1,3-5H,(H,11,12)(H,13,14)
InChI key：
XKEUZQRIANAGPB-UHFFFAOYSA-N
SMILES：
OC(=O)c1cc(cc(c1)C(=O)O)C#C
Systematic name (3)：
- 5-エチニルイソフタル酸
- 5-エチニルベンゼン-1,3-ジカルボン酸
- 5-ethynylbenzene-1,3-dicarboxylic acid
- 5-Ethynylisophthalic acid
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