Chem
J-GLOBAL ID：200907069726187223
Nikkaji number：J2.082.794G
3-(2-Benzothiazolylthio)propane-1-sulfonic acid
3-(2-ベンゾチアゾリルチオ)プロパン-1-スルホン酸
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： C10H11NO3S3
Molecular formula furigana： C10-H11-N-O3-S3
Molecular weight： 289.380
InChI：
InChI=1S/C10H11NO3S3/c12-17(13,14)7-3-6-15-10-11-8-4-1-2-5-9(8)16-10/h1-2,4-5H,3,6-7H2,(H,12,13,14)
InChI key：
XBNHRNFODJOFRU-UHFFFAOYSA-N
SMILES：
OS(=O)(=O)CCCSc1nc2ccccc2s1
Systematic name (5)：
- 3-[(ベンゾチアゾール-2-イル)チオ]プロパン-1-スルホン酸
- 3-[(2-ベンゾチアゾリル)チオ]-1-プロパンスルホン酸
- 3-(2-ベンゾチアゾリルチオ)プロパン-1-スルホン酸
- 3-(1,3-ベンゾチアゾール-2-イルスルファニル)プロパン-1-スルホン酸
- 3-(1,3-benzothiazol-2-ylsulfanyl)propane-1-sulfonic acid
- 3-[(Benzothiazole-2-yl)thio]propane-1-sulfonic acid
- 3-[(2-Benzothiazolyl)thio]-1-propanesulfonic acid
- 3-(2-Benzothiazolylthio)propane-1-sulfonic acid
Regulation number (1)：
- TSCA(4720-61-0)
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