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Propanedinitrile,2-(benzoyloxy)-2-phenyl-

更新时间:2024-01-09 20:01:20

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式
Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式
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常用名 Propanedinitrile,2-(benzoyloxy)-2-phenyl- 英文名 Propanedinitrile,2-(benzoyloxy)-2-phenyl-
CAS号 5467-94-7 分子量 262.26300
密度 1.256g/cm3 沸点 452.3ºC at 760mmHg
分子式 C16H10N2O2 熔点 N/A
MSDS N/A 闪点 197.3ºC

 名称

英文名 [dicyano(phenyl)methyl] benzoate
英文别名 更多

 物理化学性质

密度 1.256g/cm3
沸点 452.3ºC at 760mmHg
分子式 C16H10N2O2
分子量 262.26300
闪点 197.3ºC
精确质量 262.07400
PSA 73.88000
LogP 2.78606
折射率 1.597
计算化学

1.疏水参数计算参考值(XlogP):3

2.氢键供体数量:0

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:73.9

7.重原子数量:20

8.表面电荷:0

9.复杂度:426

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

 安全信息

海关编码 2926909090

 合成线路

~82%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

文献:Pazdera, Pavel; Simbera, Jan; Dlouhy, Milan Organic Preparations and Procedures International, 2011 , vol. 43, # 3 p. 285 - 291

~15%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

文献:Ando, Takashi; Kawate, Takehiko; Yamawaki, Junko; Hanafusa, Terukiyo Synthesis, 1983 , # 8 p. 637 - 638

~73%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

文献:Kantlehner, Willi; Greiner, Ulrich Liebigs Annalen der Chemie, 1990 , # 10 p. 965 - 973

~%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

文献:Shioiri,T. et al. Tetrahedron, 1976 , vol. 32, p. 2211 - 2217

~%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

文献:Fedorov; Nesterov; Shestopalo Russian Chemical Bulletin, 1997 , vol. 46, # 4 p. 838 - 840

~15%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

文献:Dillon, Keith B.; Hodgson, Martin; Parker, David Synthetic Communications, 1985 , vol. 15, # 9 p. 849 - 854

~2%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

文献:Sukata, Kazuaki Bulletin of the Chemical Society of Japan, 1987 , vol. 60, # 3 p. 1085 - 1090

~2%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

详细
文献:Sukata, Kazuaki Bulletin of the Chemical Society of Japan, 1987 , vol. 60, # 3 p. 1085 - 1090

~%

Propanedinitrile,2-(benzoyloxy)-2-phenyl-结构式

Propanedinitril...

5467-94-7

文献:Marvel et al. Journal of the American Chemical Society, 1949 , vol. 71, p. 34

 海关

海关编码 2926909090
中文概述 2926909090 其他腈基化合物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
申报要素 品名, 成分含量, 用途
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 英文别名

1,1-dicyanobenzyl benzoate
Benzoyloxy(phenyl)malonodinitril
|A,|A-Dicyanobenzyl benzoate
2-benzoyloxy-2-phenylmalononitrile
benzoyloxy-phenyl-malononitrile
benzoyl cyanide dimer
Dicyano(phenyl)methyl benzoate