15301-93-6 (托芬那辛,Ethanamine,N-methyl-2-[(2-methylphenyl)phenylmethoxy]-)

CAS号:
15301-93-6
中文名称:
托芬那辛
英文名称:
Ethanamine,N-methyl-2-[(2-methylphenyl)phenylmethoxy]-
分子式:
C17H21NO
分子量:
255.354744672775

托芬那辛(15301-93-6)名称与标识符

名称

中文别名:
托芬那辛;D-核糖-2-13C;
英文别名:
Ethanamine,N-methyl-2-[(2-methylphenyl)phenylmethoxy]-;Tofenacin;Demethylorphenadrine;N-Demethylorphenadrine;N-Desmethylorphenadrine;nororphenadrine;Tofenacine;J8.547B;N-methyl-2-[(o-methyl-a-phenylbenzyl)oxy]-ethylamine;N-Methyl-2-((2-methylphenyl)(phenyl)methoxy)ethanamine;Ethylamine, N-methyl-2-((O-methyl-alpha-phenylbenzyl)oxy)-, (+)-;UNII-WV5MS5T7YD;Ethanamine, {N-methyl-2-[(2-methylphenyl)phenylmethoxy]-,} hydrochloride;DTXSID50864578;Tofenacin, (+)-;N-(Methylamino)ethyl 2-methylbenzhydryl ether hydrochloride;N-Desmethyl Orphenadrine;BS 7331 hydrochloride;N-methyl-2-[(2-methylphenyl)-phenylmethoxy]ethanamine;Tofenacin [INN:BAN];N-methyl-2-[o-tolyl(phenyl)methoxy]ethanamine;Ethanamine, N-methyl-2-((2-methylphenyl)phenylmethoxy)-;ETHYLAMINE, N-METHYL-2-((O-METHYL-.ALPHA.-PHENYLBENZYL)OXY)-, (+)-;33431-05-9;N-Demethylorphenadrine hydrochloride;N-Demethyl orphenadrine;SCHEMBL49290;{N-Methyl-2-[(o-methyl-.alpha.-phenylbenzyl)oxy]ethylamine} hydrochloride;33431-04-8;Tofenacinum [INN-Latin];Ethylamine, {N-methyl-2-[(o-methyl-.alpha.-phenylbenzyl)oxy]-,} hydrochloride;Tofenacina [INN-Spanish];Phenyl-(o-tolylmethyl) (methylamino)ethyl ether hydrochloride;TOFENACIN [WHO-DD];Elamol;D67B6M43WW;Tofenacina;Tofenacinum;TOFENACIN [INN];TOFENACIN [MI];Q7812962;{N-Methyl-2-[.alpha.-(2-tolylbenzyl)oxy]ethylamine} hydrochloride;Tofacine;UNII-C4A112M10H;UNII-D67B6M43WW;N-Methyl-2-[(2-methylphenyl)(phenyl)methoxy]ethan-1-amine;Tofenacin, (-)-;BS 7331;Tofenacine [INN-French];EINECS 239-338-0;WV5MS5T7YD;Tofenacine hydrochloride;Ethanamine, N-methyl-2-[(2-methylphenyl)phenylmethoxy]-;NSC113809;N-Methyl-2-[(o-methyl-.alpha.-phenylbenzyl)oxy]ethylamine;15301-93-6;CHEMBL2110923;CHEBI:135046;C4A112M10H;{[2-(Phenyl-o-tolylmethoxy)ethyl]methylamine} hydrochloride;Ethylamine, N-methyl-2-((O-methyl-alpha-phenylbenzyl)oxy)-, (-)-;N-Methyl-2-[(2-methylphenyl)(phenyl)methoxy]ethanamine #;N-Methyl-N-(2-((2-methylphenyl)(phenyl)methoxy)ethyl)amine;FT-0675264;ETHYLAMINE, N-METHYL-2-((O-METHYL-.ALPHA.-PHENYLBENZYL)OXY)-, (-)-;N-METHYL-2-((O-METHYL-.ALPHA.-PHENYLBENZYL)OXY)ETHYLAMINE;NS00051629;NSC169432;PNYKGCPSFKLFKA-UHFFFAOYSA-N;Tofenacin (free base);

标识符

InChIKey:
PNYKGCPSFKLFKA-UHFFFAOYSA-N
Inchi:
1S/C17H21NO/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
SMILES:
O(CCNC)C(C1C=CC=CC=1)C1C=CC=CC=1C

托芬那辛(15301-93-6)物化性质

实验特性

  • LogP : 3.71130
  • PSA : 21.26000

计算特性

  • 精确分子量 : 255.16200
  • 氢键供体数量 : 1
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 6
  • 同位素质量 : 255.162314293g/mol
  • 重原子数量 : 19
  • 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 : 1
  • 疏水参数计算参考值(XlogP) : 3.3
  • 拓扑分子极性表面积 : 21.3Ų

托芬那辛(15301-93-6)推荐厂家 更多厂家(1)

公司名称手机号/电话联系人QQ微信询单
上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
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