uspto-grants-1986_09 · 10.6084/m9.figshare.5104873.v1 · US04610812
查看IDENTITY
结构与身份
- 标准SMILES
- CC(=O)OC(C)CC(C)C
- InChIKey
- CPIVYSAVIPTCCX-UHFFFAOYSA-N
- 分子式
- C8H16O2
- 平均分子量
- 144.21 g/mol
- 单同位素质量
- 144.11502975
COMPUTED
结构计算性质
- XLogP
- 2.2
- 极性表面积
- 26.3 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 4
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 108
物化、安全与法规信息正在同步。
ALIASES
名称与别名
1,3-Dimethylbutyl acetate4-METHYL-2-PENTYL ACETATE108-84-9Methylamyl acetateMethylisoamyl acetate4-Methyl-2-amyl acetatesec-Hexyl acetate1,3-Dimethylbutyl ethanoateMethyl amyl acetateMethylisobutylcarbinol acetateMethylisobutylcarbinyl acetate2-Pentanol, 4-methyl-, acetate4-Methyl-2-pentanol, acetateNSC 5674-Methyl-2-pentanol acetateAcetic acid, 1,3-dimethylbutyl esterHSDB 1155IP9ZB28RWN2-Pentanol, 4-methyl-, 2-acetateEINECS 203-621-7
REACTIONS