3-(4-甲基-1H-咪唑-1-基)-5-(三氟甲基)苯胺 | 641571-11-1
中文名称:
3-(4-甲基-1H-咪唑-1-基)-5-(三氟甲基)苯胺
英文名称:
3-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline
CAS No.:
641571-11-1
分子式:
C1 1 H1 0 F3 N3
分子量:
241.2124
名称和标识符
MDL
MFCD11846236
InChIKey
WWTGXYAJVXKEKL-UHFFFAOYSA-N
Inchi
1S/C11H10F3N3/c1-7-5-17(6-16-7)10-3-8(11(12,13)14)2-9(15)4-10/h2-6H,15H2,1H3
SMILES
FC(C1=C([H])C(=C([H])C(=C1[H])N1C([H])=NC(C([H])([H])[H])=C1[H])N([H])[H])(F)F
别名信息
- 中文别名 -
3-(4-甲基-1H-咪唑-1-基)-5-(三氟甲基)苯胺
1-[3-氨基-5-(三氟甲基)苯基]-4-甲基咪唑
2-氯-7-羟基吩噻嗪
3-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline 3-(4-甲基-1H-咪唑-1-基)-5-(三氟甲基)苯胺
3-(4-甲基-1H-咪唑-1-基)-5-(三氟甲基)苯胺,3-(4-Methyl-1H-imidazol-1-yl)-5-trifluoromethylaniline
尼罗替尼中间体
尼罗替尼中间体2
尼罗替尼中间体3-(4-甲基-1H-咪唑-1-基)-5-(三氟甲基)苯胺
3-(4-甲基咪唑)-5-三氟甲基苯胺
尼罗替尼中间体4
尼洛替尼中间体3
- 英文别名 -
3-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline
1-(3-Amino-5-trifluoromethylphenyl)-4-methylimidazole
3-(4-Methyl-1H-imidazol-1-yl)-5-trifluoromethylaniline
3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)aniline
3-(4-Methyl-imidazol-1-yl)-5-trifluoromethyl-phenylamine
3-(trifluoromethyl)-5-(4-methyl-1H-imidazol-1-yl)benzenamine
Benzenamine, 3-(4-methyl-1H-imidazol-1-yl)-5- (trifluoromethyl)-
Nilotinib Genotoxic Impurity 1
Rapamycin
1-[3-Amino-5-(trifluoromethyl)phenyl]-4-methylimidazole
Benzenamine, 3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)-
3-(4-METHYL-1H-IMIDAZOL-1-YL)-5-(TRIFLUOROMETHYL)BENZENAMINE
3-(4-Methyl-1-imidazolyl)-5-(trifluoromethyl)aniline
3-(4-methyl-1H-imidazole-1-yl)-5-(trifluoromethyl)aniline
WWTGXYAJV
3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline
641571-11-1
BDBM50584383
CS-W019667
3-(4-methylimidazol-1-yl)-5-trifluoromethyl-phenylamine
SCHEMBL1505804
Nilotinib impurity A
5-(4-Methyl-1H-imidazol-1-yl)-3-trifluoromethyl-phenylamine
AC-8508
BCP04529
GS-4414
CHEMBL5080162
AKOS015842181
NS00009975
AM20090650
3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)benzeneamine
A8805
3-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl) aniline ?
SCHEMBL589390
3-(TRIFLUOROMETHYL)-5-(4-METHYL-1H-IMIDAZOL-1-YL)BENZENAMINE
3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)-benzenamine
UNII-5LLI0Q7APP
SY015266
3-(4-METHYL-IMIDAZOL-1-YL)-5-TRIFLUOROMETHYL-PHENYLAMINE
NILOTINIB HYDROCHLORIDE MONOHYDRATE IMPURITY A [EP IMPURITY]
TU5
Z1741976042
3-(4-Methyl-1H-imidazol-1yl)-5-(trifluoromethyl)aniline
FT-0655008
M2634
DTXSID10475604
BENZENAMINE, 3-(4-METHYL-1H-IMIDAZOL-1-YL)-5-(TRIFLUOROMETHYL)
MFCD11846236
EN300-5601139
5LLI0Q7APP
MB10071
Q-101351
5-(4-methyl-1H-imidazol-1-yl)-3-(trifluoromethyl)-benzenamine
EC 688-269-6
物化性质
实验特性
LogP
3.36290
PSA
43.84000
折射率
1.553
沸点
379.8°C at 760 mmHg
熔点
128.0 to 132.0 deg-C
闪点
183.5℃
颜色与性状
No data available
密度
1.35
计算特性
精确分子量
241.08300
氢键供体数量
1
氢键受体数量
5
可旋转化学键数量
1
同位素质量
241.083
重原子数量
17
复杂度
269
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
0
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)
2.3
拓扑分子极性表面积
43.8
海关数据
海关编码
2933290090
海关数据
中国海关编码:
2933290090
概述:
2933290090. 其他结构含非稠合咪唑环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
Summary:
2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
参考资料
Reaxys RN
11280392
Beilstein
M158498