73344-75-9 (伊伐布雷定杂质18,(3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methanamine)

CAS号:
73344-75-9
中文名称:
伊伐布雷定杂质18
英文名称:
(3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methanamine
分子式:
C11H15NO2
分子量:
193.242303133011

伊伐布雷定杂质18(73344-75-9)名称与标识符

名称

中文别名:
4,5-二甲氧基-1-(氨基甲基)苯并环丁烷;4,5-甲氧基-1-氨基甲基-苯并环丁烷盐酸盐;伊伐布雷定杂质18;
英文别名:
(3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methanamine;(4,5-dimethoxy-1,2-dihydrocyclobutabenzen-1-yl)methanamine;4,5-Dimethoxy-1-(aminomethyl)benzocyclobutane;Bicyclo[4.2.0]octa-1,3,5-triene-7-methanamine,3,4-dimethoxy-;C-(3,4-DIMETHOXY-BICYCLO[4.2.0]OCTA-1(6),2,4-TRIEN-7-YL)-METHYLAMINE;3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene-7-methanamine;(3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methanamine;1-(3,4-DIMETHOXYBICYCLO(4.2.0)OCTA-1(6),2,4-TRIEN-7-YL)METHANAMINE;AKOS006331068;NSC 154409;P16957;UNII-BN386JHN8A;CS-0055028;BCP20378;BN386JHN8A;4,5-Dimethoxy-1-(aminomethyl)benzocyclobutane hydrochloride;3,4-DIMETHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIENE-7-METHANAMINE;NSC268229;NSC 268229;(3,4-dimethoxy-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl)methanamine;NSC154409;EC 917-818-7;(3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methylamine;322VUN7K2C;1-(3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methanamine;JDZSBHBIJDIACW-UHFFFAOYSA-N;NS00001749;73344-75-9;SCHEMBL383341;DTXSID501191510;4,5-Dimethoxy-1-(aminomethyl)-benzocyclobutane;UNII-322VUN7K2C;F19268;Ivabradine Impurity f;YCA34475;A901544;{Bicyclo[4.2.0]octa-1,3,5-triene-7-methanamine,} 3,4-dimethoxy-, hydrochloride, (.+-.)-;AS-53729;AMY40493;Ivabradine Impurity 18;BICYCLO(4.2.0)OCTA-1,3,5-TRIENE-7-METHANAMINE, 3,4-DIMETHOXY-;(3,4-Dimethoxy-bicyclo(4.2.0)octa-1,3,5-trien-7-yl)-methylamine;1-(3,4-DIMETHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIEN-7-YL)METHANAMINE;MFCD09264101;(3,4-Dimethoxybicyclo(4.2.0)octa-1,3,5-trien-7-yl)methanamine;Bicyclo[4.2.0]octa-1,3,5-triene-7-methanamine, 3,4-dimethoxy-;DS-017220;1-(3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methanamine; 3,4-Dimethoxy-bicyclo[4.2.0]octa-1,3,5-triene-7-methanamine;1-{3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl}methanamine;

标识符

MDL:
MFCD09264101
InChIKey:
JDZSBHBIJDIACW-UHFFFAOYSA-N
Inchi:
1S/C11H15NO2/c1-13-10-4-7-3-8(6-12)9(7)5-11(10)14-2/h4-5,8H,3,6,12H2,1-2H3
SMILES:
O(C)C1C(=CC2=C(C=1)C(CN)C2)OC

伊伐布雷定杂质18(73344-75-9)物化性质

实验特性

  • 沸点 : 309 ºC
  • 闪点 : 153 ºC
  • 密度 : 1.113

计算特性

  • 精确分子量 : 193.11
  • 氢键供体数量 : 1
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 3
  • 同位素质量 : 193.11
  • 重原子数量 : 14
  • 复杂度 : 198
  • 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) : 0
  • 拓扑分子极性表面积 : 44.5A^2

伊伐布雷定杂质18(73344-75-9)安全信息