Chem
J-GLOBAL ID：200907082345993530
Nikkaji number：J2.659.218F
4-(Phenylsulfonyl)-4,5-hexadienoic acid
4-(フェニルスルホニル)-4,5-ヘキサジエン酸
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： C12H12O4S
Molecular formula furigana： C12-H12-O4-S
Molecular weight： 252.280
InChI：
InChI=1S/C12H12O4S/c1-2-10(8-9-12(13)14)17(15,16)11-6-4-3-5-7-11/h3-7H,1,8-9H2,(H,13,14)
InChI key：
DNLGSRMIXWZVIK-UHFFFAOYSA-N
SMILES：
OC(=O)CCC(=C=C)S(=O)(=O)c1ccccc1
Systematic name (3)：
- 4-(フェニルスルホニル)-4,5-ヘキサジエン酸
- 4-(ベンゼンスルホニル)ヘキサ-4,5-ジエン酸
- 4-(benzenesulfonyl)hexa-4,5-dienoic acid
- 4-(Phenylsulfonyl)-4,5-hexadienoic acid
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