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57375-63-0

57375-63-0结构式
57375-63-0结构式
  • 常用中文名:棉胺宁
  • 常用英文名:phenisopham
  • CAS号:57375-63-0
  • 分子式:C19H22N2O4
  • 分子量:342.38900
  • 发布时间:2018-08-13 13:08:26
  • 更新时间:2024-01-14 03:24:24

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中文名 棉胺宁
英文名 phenisopham
中文别名 敌克草
英文别名 3-[[(1-methylethoxy)carbonyl]amino]phenyl N-ethyl-N-phenylcarbamate
Phenisopham
3-[(propan-2-yloxy)formamido]phenyl ethyl(phenyl)carbamate
EINECS 260-706-1
Verdinal
[3-(propan-2-yloxycarbonylamino)phenyl] N-ethyl-N-phenylcarbamate
3-(isopropoxycarbonylamino)phenyl N-ethylcarbanilate
密度 1.212g/cm3
沸点 428.1ºC at 760mmHg
分子式 C19H22N2O4
分子量 342.38900
闪点 212.7ºC
精确质量 342.15800
PSA 67.87000
LogP 4.74180
折射率 1.601
分子结构

1、 摩尔折射率:100.36

2、 摩尔体积(cm3/mol):308.0

3、 等张比容(90.2K):806.4

4、 表面张力(dyne/cm):46.9

5、 极化率(10-24cm3):39.78

计算化学

1.疏水参数计算参考值(XlogP):4

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:7

5.互变异构体数量:2

6.拓扑分子极性表面积67.9

7.重原子数量:25

8.表面电荷:0

9.复杂度:435

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

CHEMICAL IDENTIFICATION

RTECS NUMBER :
FB0422000
CHEMICAL NAME :
Carbamic acid, ethylphenyl-, 3-(((1-methylethoxy)carbonyl)amino)phenyl ester
CAS REGISTRY NUMBER :
57375-63-0
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C19-H22-N2-O4
MOLECULAR WEIGHT :
342.43

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>4 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PEMNDP Pesticide Manual. (The British Crop Protection Council, 20 Bridport Rd., Thornton Heath CR4 7QG, UK) V.1- 1968- Volume(issue)/page/year: 8,651,1987
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PEMNDP Pesticide Manual. (The British Crop Protection Council, 20 Bridport Rd., Thornton Heath CR4 7QG, UK) V.1- 1968- Volume(issue)/page/year: 8,651,1987
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PEMNDP Pesticide Manual. (The British Crop Protection Council, 20 Bridport Rd., Thornton Heath CR4 7QG, UK) V.1- 1968- Volume(issue)/page/year: 8,651,1987
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Bird - duck
DOSE/DURATION :
>4 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PEMNDP Pesticide Manual. (The British Crop Protection Council, 20 Bridport Rd., Thornton Heath CR4 7QG, UK) V.1- 1968- Volume(issue)/page/year: 8,651,1987

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57375-63-0结构式

57375-63-0

文献:Schering AG Patent: FR2272983DE2413933 , 19751975 ; Chem.Abstr., 1975 , vol. 83, # 205989
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