55514-14-2

• 常用中文名：3-甲基-2-(甲硫基)苯并[d]噻唑-3-鎓 4-甲基苯磺酸盐
• 常用英文名：3-METHYL-2-(METHYLTHIO)-BENZOTHIAZOL-IUM-p-TOLUENESULFONATE
• CAS号：55514-14-2
• 分子式：C₁₆H₁₇NO₃S₃
• 分子量：367.50600
• 发布时间：2016-05-14 19:10:34
• 更新时间：2024-01-09 15:14:17

名称

• 中文名: 3-甲基-2-(甲硫基)苯并[d]噻唑-3-鎓 4-甲基苯磺酸盐
• 英文名: 4-methylbenzenesulfonate,3-methyl-2-methylsulfanyl-1,3-benzothiazol-3-ium
• 英文别名: 3-Methyl-2-methylthiobenzothiozolium p-toluenesulfonate; BENZOTHIAZOLIUM,3-METHYL-2-METHYLTHIO-,p-TOLUENESULFONATE; EINECS 259-687-2; N-methyl-2-methylthiobenzothiazolium tosylate; N-methyl-2-methylthiobenzothiazolium p-toluenesulfonate

物化性质

• 分子式: C₁₆H₁₇NO₃S₃
• 分子量: 367.50600
• 精确质量: 367.03700
• PSA: 123.00000
• LogP: 4.42760
• 储存条件: 2-8°C， 惰性气体

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : DL7080000 CHEMICAL NAME : Benzothiazolium, 3-methyl-2-methylthio-, p-toluenesulfonate CAS REGISTRY NUMBER : 55514-14-2 LAST UPDATED : 199701 DATA ITEMS CITED : 2 MOLECULAR FORMULA : C9-H10-N-S2.C7-H7-O3-S MOLECULAR WEIGHT : 367.52 WISWESSER LINE NOTATION : T56 BK DSJ B1 CS1 &WSO&R D1 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 180 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#02000

合成路线

615-22-5 80-48-8 ~87% 55514-14-2

文献：CANCER RESEARCH TECHNOLOGY LIMITED Patent: US2009/247579 A1, 2009 ; Location in patent: Page/Page column 35 ;

149-30-4 ~% 55514-14-2

文献：Beilenson; Hamer Journal of the Chemical Society, 1939 , p. 143,149

95-51-2 ~% 55514-14-2

文献：Li, Xiaokai; Srinivasan, Sharan R.; Connarn, Jamie; Ahmad, Atta; Young, Zapporah T.; Kabza, Adam M.; Zuiderweg, Erik. R. P.; Sun, Duxin; Gestwicki, Jason E. ACS Medicinal Chemistry Letters, 2013 , vol. 4, # 11 p. 1042 - 1047

2254-94-6 80-48-8 ~% 55514-14-2

文献：Fry; Kendall Journal of the Chemical Society, 1951 , p. 1723,1725

615-22-5 ~% 55514-14-2

文献：Fry; Kendall Journal of the Chemical Society, 1951 , p. 1723,1725

上下游产品

上游产品  5
615-22-5 80-48-8 149-30-4 95-51-2
2254-94-6
下游产品  1
55922-69-5