10488-36-5 (盐酸托芬那辛,Tofenacin Hydrochloride Salt)

CAS号:
10488-36-5
中文名称:
盐酸托芬那辛
英文名称:
Tofenacin Hydrochloride Salt
分子式:
C17H22ClNO
分子量:
291.815683841705

盐酸托芬那辛(10488-36-5)名称与标识符

名称

中文别名:
盐酸托芬那辛;枸櫞酸奧芬那君杂质C;枸櫞酸邻甲苯海拉明杂质C;奥芬那君相关物质C;奧芬那君相关物质C USP标准品;枸橼酸奧芬那君杂质C;邻甲苯海拉明杂质 标准品;盐酸邻甲苯海拉明杂质;N-去甲奧芬那君盐酸盐;盐酸脱氧邻甲苯海明;托芬那辛盐酸盐;
英文别名:
Tofenacin hydrochloride;N-Demethylorphenadrine hydrochloride;Orphenadrine Related Compound C;N-DESMETHYLORPHENADRINE HYDROCHLORIDE;Tofenacin Hydrochloride Salt;Orphenadrine Related Compound C (20 mg) (N-methyl-[2-(2-methylbenhydryloxy)ethyl]amine hydrochloride);N-Methyl-2-[(2-methylphenyl)phenylmethoxy]ethanamine hydrochloride;BS 7331;Elamol;NSC 113809;NSC 169432;Tofacine;Tofenacine hydrochloride;N-Methyl-2-[(O-methyl-alpha-phenylbenzyl)oxy]ethylamine hydrochloride;N-Methyl-2-[.alpha.-(2-tolylbenzyl)oxy]ethylamine hydrochloride;Tofenacin hydrochloride (USAN);WLN: 1M2OYR&R B1 &GH;SCHEMBL637494;Q27256941;CHEMBL2106673;N-methyl-[2-(2- methylbenzhydryloxy)ethyl]amine hydrochloride;N-(Methylamino)ethyl 2-methylbenzhydryl ether hydrochloride;BS 7331 hydrochloride;10488-36-5;NSC-113809;TOFENACIN HYDROCHLORIDE [MART.];Phenyl-(o-tolylmethyl) (methylamino)ethyl ether hydrochloride;TOFENACIN HYDROCHLORIDE [MI];Tofenacin hydrochloride [USAN];[2-(Phenyl-o-tolylmethoxy)ethyl]methylamine hydrochloride;3A10ND4DWR;D06175;N-methyl-2-[(2-methylphenyl)-phenylmethoxy]ethanamine;hydrochloride;Tofenacin HCl;A929671;NS00087297;Ethanamine, N-methyl-2-((2-methylphenyl)phenylmethoxy)-, hydrochloride;N-Methyl-2-[(o-methyl-.alpha.-phenylbenzyl)oxy]ethylamine hydrochloride;NSC-169432;NSC113809;N-Desmethylorphenadrine Hydrochloride; Orphenadrine Related Compound C as Hydrochloride;TOFENACIN HYDROCHLORIDE [WHO-DD];tofenacinhydrochloride;NSC169432;YAXWIYFUVISXRS-UHFFFAOYSA-N;

标识符

InChIKey:
YAXWIYFUVISXRS-UHFFFAOYSA-N
Inchi:
1S/C17H21NO.ClH/c1-14-8-6-7-11-16(14)17(19-13-12-18-2)15-9-4-3-5-10-15;/h3-11,17-18H,12-13H2,1-2H3;1H
SMILES:
Cl.O(CCNC)C(C1C=CC=CC=1)C1C=CC=CC=1C

盐酸托芬那辛(10488-36-5)物化性质

实验特性

  • LogP : 4.51330
  • PSA : 21.26000
  • 熔点 : 147-148 ºC (ethanol ethyl ether )
  • 溶解度 : Chloroform (Slightly), Methanol (Slightly)

计算特性

  • 精确分子量 : 291.13900
  • 氢键供体数量 : 2
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 6
  • 同位素质量 : 291.1389920g/mol
  • 重原子数量 : 20
  • 复杂度 : 237
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 1
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 2
  • 拓扑分子极性表面积 : 21.3Ų

盐酸托芬那辛(10488-36-5)国际标准相关数据

EINECS:
234-011-9

盐酸托芬那辛(10488-36-5)推荐厂家 更多厂家(3)

公司名称手机号/电话联系人QQ微信询单
上海源叶生物科技有限公司 15026964105
15026964105
汤思磊 2881489226
询单
湖北扬信医药科技有限公司 18071854684
0714-3999001
程舒畅 2885409691
询单
上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
询单

盐酸托芬那辛(10488-36-5)参考资料

Reaxys RN:
PubChem CID: