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Pentanamide, 4-methyl-

更新时间:2025-08-25 16:46:28

Pentanamide, 4-methyl-结构式
Pentanamide, 4-methyl-结构式
品牌特惠专场
常用名 Pentanamide, 4-methyl- 英文名 Pentanamide, 4-methyl-
CAS号 1119-29-5 分子量 115.17400
密度 0.894g/cm3 沸点 245.2ºC at 760 mmHg
分子式 C6H13NO 熔点 N/A
MSDS N/A 闪点 102.1ºC

 Pentanamide, 4-methyl-名称

英文名 4-methylpentanamide
英文别名 更多

 Pentanamide, 4-methyl-物理化学性质

密度 0.894g/cm3
沸点 245.2ºC at 760 mmHg
分子式 C6H13NO
分子量 115.17400
闪点 102.1ºC
精确质量 115.10000
PSA 43.09000
LogP 1.60820
蒸汽压 0.0291mmHg at 25°C
折射率 1.431
稳定性

1. 存在于烟气中。

分子结构

1、 摩尔折射率:33.36

2、 摩尔体积(cm3/mol):128.7

3、 等张比容(90.2K):302.3

4、 表面张力(dyne/cm):30.4

5、 极化率(10-24cm3):13.22

计算化学

1.疏水参数计算参考值(XlogP):0.8

2.氢键供体数量:1

3.氢键受体数量:1

4.可旋转化学键数量:3

5.互变异构体数量:3

6.拓扑分子极性表面积43.1

7.重原子数量:8

8.表面电荷:0

9.复杂度:78.6

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):120~121

2. 溶解性:溶于水、乙醇。

 Pentanamide, 4-methyl-合成线路

~57%

Pentanamide, 4-methyl-结构式

Pentanamide, 4-...

1119-29-5

文献:Artman, Linda D.; Balandrin, Manuel F.; Moe, Scott T.; Van Wagenen, Bradford C.; Pesyan, Amir Patent: US2006/25477 A1, 2006 ; Location in patent: Page/Page column 7 ;

~%

Pentanamide, 4-methyl-结构式

Pentanamide, 4-...

1119-29-5

文献:Winthrop-Stearns Inc. Patent: US2456785 , 1945 ; Full Text Show Details King; McMillan Journal of the American Chemical Society, 1946 , vol. 68, p. 1371,2338

~70%

Pentanamide, 4-methyl-结构式

Pentanamide, 4-...

1119-29-5

文献:Dupuy; Petrier; Sarandeses; Luche Synthetic Communications, 1991 , vol. 21, # 5 p. 643 - 651

~%

Pentanamide, 4-methyl-结构式

Pentanamide, 4-...

1119-29-5

文献:Mc Master; Langreck Journal of the American Chemical Society, 1917 , vol. 39, p. 108

~%

Pentanamide, 4-methyl-结构式

Pentanamide, 4-...

1119-29-5

文献:Mazzocchi, Paul H.; Jameson, William; Nishiyama, Tomikiro; DeCamp, Ann Tetrahedron Letters, 1980 , vol. 21, p. 989 - 992

~%

Pentanamide, 4-methyl-结构式

Pentanamide, 4-...

1119-29-5

文献:Dangjan; Megrojan; Mussachanjan Doklady Akad.armjansk.S.S.S.R.Chem.Abstr., 1945 , p. II Nr.4 S.107 Doklady Akad.armjansk.S.S.S.R.Chem.Abstr., 1946 , p. 3399

 Pentanamide, 4-methyl-英文别名

Isobutylacetamid
4-Methylvaleramide
Pentanamide,4-methyl
Valeramide,4-methyl
4-methyl-pentanamide
Isohexanamide
amide of 4-methyl pentanoic acid
4-Methyl-valeriansaeure-amid
4-Methyl-valeramid
4-methyl-valeric acid amide
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