2-Naphthalenecarboxamide,3-hydroxy-4-[2-[2-methoxy-5-[(phenylamino)carbonyl]phenyl]diazenyl]-N-phenyl-
- 中文别名:C.I.颜料红32
- 中文释义:C.I.颜料红32;3-羟基-4-[[2-甲氧基-5-[(苯氨基)羰基]苯基]偶氮]-N-苯基-2-萘甲酰胺;永固红 FR;坚固桃红BR;颜料红32
- 英文别名:(4Z)-4-[[2-methoxy-5-(phenylcarbamoyl)phenyl]hydrazinylidene]-3-oxo-N-phenylnaphthalene-2-carboxamide;
2-Naphthalenecarboxamide,3-hydroxy-4-(2-(2-methoxy-5-((phenylamino)carbonyl)phenyl)diazenyl)-N-phenyl;
2-Naphthalenecarboxamide,3-hydroxy-4-((2-methoxy-5-((phenylamino)carbonyl)phenyl)azo)-N-phenyl;
V0985;
EINECS 229-099-0;
4-((5-(Anilino)carbonyl-2-methoxyphenyl)azo)-3-hydroxy-N-phenylnaphthalene-2-carboxamide;
Pigment Red 32
- CAS No.:6410-29-3
- 分子式:
C31H24N4O4
- 分子量:516.55
- 精确分子量:516.18000
- PSA:112.38000
- InChI:InChI=1/C31H24N4O4/c1-39-27-17-16-21(30(37)32-22-11-4-2-5-12-22)19-26(27)34-35-28-24-15-9-8-10-20(24)18-25(29(28)36)31(38)33-23-13-6-3-7-14-23/h2-19,34H,1H3,(H,32,37)(H,33,38)/b35-28-
- 分子结构式:
分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):5.5
2.氢键供体数量:3
3.氢键受体数量:6
4.可旋转化学键数量:7
5.互变异构体数量:22
6.拓扑分子极性表面积:109
7.重原子数量:39
8.表面电荷:0
9.复杂度:950
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:0
13.确定化学键立构中心数量:1
14.不确定化学键立构中心数量:0
15.共价键单元数量:1