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3-cyano-3-methylbutanamide

更新时间:2024-01-09 13:00:06

3-cyano-3-methylbutanamide结构式
3-cyano-3-methylbutanamide结构式
委托求购
常用名 3-cyano-3-methylbutanamide 英文名 3-cyano-3-methylbutanamide
CAS号 61892-66-8 分子量 126.15600
密度 N/A 沸点 N/A
分子式 C6H10N2O 熔点 N/A
MSDS N/A 闪点 N/A

 3-cyano-3-methylbutanamide名称

英文名 3-cyano-3-methylbutanamide
英文别名 更多

 3-cyano-3-methylbutanamide物理化学性质

分子式 C6H10N2O
分子量 126.15600
精确质量 126.07900
PSA 67.87000
LogP 1.56128
稳定性

1. 存在于烟气中。

分子结构

1、 摩尔折射率:33.29

2、 摩尔体积(cm3/mol):121.8

3、 等张比容(90.2K):308.3

4、 表面张力(dyne/cm):41.0

5、 极化率(10-24cm3):13.19

计算化学

1.疏水参数计算参考值(XlogP):-0.3

2.氢键供体数量:1

3.氢键受体数量:2

4.可旋转化学键数量:2

5.互变异构体数量:2

6.拓扑分子极性表面积66.9

7.重原子数量:9

8.表面电荷:0

9.复杂度:163

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

更多

1. 熔点(ºC):106~108

 3-cyano-3-methylbutanamide合成线路

~42%

3-cyano-3-methylbutanamide结构式

3-cyano-3-methy...

61892-66-8

文献:Arnott, David M.; Harrison, Peter J.; Henderson, Graeme B.; Sheng, Zhi-Chu; Leeper, Finian J.; Battersby, Alan R. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1989 , p. 265 - 278

~%

3-cyano-3-methylbutanamide结构式

3-cyano-3-methy...

61892-66-8

文献:Arnott, David M.; Harrison, Peter J.; Henderson, Graeme B.; Sheng, Zhi-Chu; Leeper, Finian J.; Battersby, Alan R. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1989 , p. 265 - 278

~%

3-cyano-3-methylbutanamide结构式

3-cyano-3-methy...

61892-66-8

文献:Arnott, David M.; Harrison, Peter J.; Henderson, Graeme B.; Sheng, Zhi-Chu; Leeper, Finian J.; Battersby, Alan R. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1989 , p. 265 - 278

~%

3-cyano-3-methylbutanamide结构式

3-cyano-3-methy...

61892-66-8

文献:Arnott, David M.; Harrison, Peter J.; Henderson, Graeme B.; Sheng, Zhi-Chu; Leeper, Finian J.; Battersby, Alan R. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1989 , p. 265 - 278

 3-cyano-3-methylbutanamide英文别名

3-cyano-3-methylbutyramide
Butanamide,3-cyano-3-methyl
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