N-乙基-N-(2-羟基乙基)-4-亚硝基苯胺

N-乙基-N-(2-羟基乙基)-4-亚硝基苯胺 基本信息
CAS号 135-72-8 分子式 C10H14N2O2
分子量 194.23000 精确质量  194.10600
PSA  52.90000 LogP  1.90310

基本信息 展开↓

CAS号:
135-72-8
3D弹球模型:
立即前往扯扯看
分子式:
C10H14N2O2
分子量:
194.23000
中文名称:
N-乙基-N-(2-羟基乙基)-4-亚硝基苯胺
英文名称:
2-(N-ethyl-4-nitrosoanilino)ethanol
中文别名:
N-乙基-N-(2-羟基乙基)-4-亚硝基苯胺;
4-亚硝基-N-乙基-N-(β-羟乙基)苯胺;
para-quaterphenyl;
4,4-diphenylbiphenyl;
p-Tetraphenyl;
1,1':4',1'':4'',1'''-quaterphenyl;
4-Quaterphenyl;
4-Biphenylamine, 4'-chloro-;
4'-chlorobiphenyl-4-amine;
4'-Chloro-biphenyl-4-amine;
4'-Chlorobiphenyl-4-ylamine;
naphthol as-D;
N,N'-dithiodi-o-phenylenedibenzamide;
2-hydroxynaphthalene;
beta naphthol;
beta-naphthol;
b-naphtol;
naphthalen-2-ol;
2-Naphthol;
N,N-Diethyl-3-methylbenzamide;
N,N-Diethyl-3-methylbenzolcarboxamid;
N,N-Diethyl-m-methylbenzamide;
N,N-Diethyl-m-toluamide (DEET);
Diethyltoluamide;
Phenylphenol, sodium salt;
SOPP;
stopmold b;
topane;
O-Phenyl phenol sodium salt tetrahyate;
sodium biphenyl-2-olate;
sodium biphenyl-2-olate hydrate (1:1:4);
biphenyl-2-olate;
[1,1'-biphenyl]-2-ol, sodium salt (1:1);
Ortho-phenylphenol,sodium salt;
2-hydroxybiphenyl sodium salt tetrahydrate;
2-hydroxybiphenyl sodium salt;
Antioxidant T501;
3-butyl-4-methylphenol;
2-butyl-3-methy;
Sodium salt of cacodylic acid;
Sodium, ((dimethylarsino)oxy)-, As-oxide;
UNII-OC4237N148;
Arsine oxide, dimethylhydroxy-, sodium salt;
Arsine o
英文别名:
2-(N-ethyl-4-nitrosoanilino)ethanol;
Ethanol, 2-(ethyl(4-nitrosophenyl)amino)-;
NSC 103361;
p-Nitroso-N-ethyl-N-(2-hydroxyethyl)aniline;
Ethanol, 2-(N-ethyl-p-nitrosoanilino)-;
2-[ethyl(4-nitrosophenyl)amino]ethanol;
2-(N-Ethyl-p-nitrosoanilino)ethanol;
4-Biphenylamine, 4'-chloro-;
4'-chlorobiphenyl-4-amine;
4'-Chloro-biphenyl-4-amine;
4'-Chlorobiphenyl-4-ylamine;
naphthol as-D;
N,N'-dithiodi-o-phenylenedibenzamide;
2-hydroxynaphthalene;
beta naphthol;
beta-naphthol;
b-naphtol;
naphthalen-2-ol;
2-Naphthol;
N,N-Diethyl-3-methylbenzamide;
N,N-Diethyl-3-methylbenzolcarboxamid;
N,N-Diethyl-m-methylbenzamide;
N,N-Diethyl-m-toluamide (DEET);
Diethyltoluamide;
Phenylphenol, sodium salt;
SOPP;
stopmold b;
topane;
O-Phenyl phenol sodium salt tetrahyate;
sodium biphenyl-2-olate;
sodium biphenyl-2-olate hydrate (1:1:4);
biphenyl-2-olate;
[1,1'-biphenyl]-2-ol, sodium salt (1:1);
Ortho-phenylphenol,sodium salt;
2-hydroxybiphenyl sodium salt tetrahydrate;
2-hydroxybiphenyl sodium salt;
Antioxidant T501;
3-butyl-4-methylphenol;
2-butyl-3-methy;
Sodium salt of cacodylic acid;
Sodium, ((dimethylarsin
精确分子量/精确质量:
194.10600
极性分子表面积/PSA:
52.90000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:
205-216-0
InChI:
InChI=1/C10H14N2O2/c1-2-12(7-8-13)10-5-3-9(11-14)4-6-10/h3-6,13H,2,7-8H2,1H3

物化性质展开↓

密度:
1.11g/cm3
沸点:
358.5ºC at 760mmHg
闪点:
170.6ºC
折射率:
1.539
蒸汽压:
9.16E-06mmHg at 25°C

分子结构与计算化学数据展开↓

分子结构数据


1、  摩尔折射率:54.60

2、  摩尔体积(cm3/mol):174.2

3、  等张比容(90.2K):443.3

4、  表面张力(dyne/cm):41.9

5、  极化率(10-24cm3):21.64

计算化学数据


1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:1

3.氢键受体数量:4

4.可旋转化学键数量:4

5.互变异构体数量:无

6.拓扑分子极性表面积52.9

7.重原子数量:14

8.表面电荷:0

9.复杂度:168

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:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

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