Benzothiazolium, 3-methyl-, 4-methylbenzenesulfonate (1:1) 3-甲基苯并噻唑翁对甲基苯磺酸盐

CAS 6112-39-6 MFCD N/A

化学结构图

6112-39-6
SMILES: C[n+]1csc2ccccc21.Cc1ccc(S(=O)(=O)[O-])cc1

化学属性

Mol. FormulaC8H8NS.C7H7O3S
Mol. Weight321.43

别名和识别编码

Chemical NameBenzothiazolium, 3-methyl-, 4-methylbenzenesulfonate (1:1)
Chemical Name Translation3-甲基苯并噻唑翁对甲基苯磺酸盐
Chemicalbook IDCB7905252
Synonym Benzothiazolium, 3-methyl-, salt with 4-methylbenzenesulfonic acid (1:1) 3-Methylbenzothiazolium-p-toluene sulfonate
Wiswesser Line NotationT56 BK DSJ B1 &WSO&R D1
CAS Number6112-39-6
InChIKeyVSLLSCGWLKZXJL-UHFFFAOYSA-M
PubChem Substance ID22489
InChIInChI=1S/C8H8NS.C7H8O3S/c1-9-6-10-8-5-3-2-4-7(8)9;1-6-2-4-7(5-3-6)11(8,9)10/h2-6H,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
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安全信息

RTECSDL7100000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 800 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   KODAK* Kodak Company Reports.  (343 State St., Rochester, NY 14650)
   Volume(issue)/page/year: 21MAY1971

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1600 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   KODAK* Kodak Company Reports.  (343 State St., Rochester, NY 14650)
   Volume(issue)/page/year: 21MAY1971

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : >1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   KODAK* Kodak Company Reports.  (343 State St., Rochester, NY 14650)
   Volume(issue)/page/year: 21MAY1971

系列性分类

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