HRID26177
uspto-grants-1979_04
作为反应物
uspto-grants-1979_04 · 10.6084/m9.figshare.5104873.v1 · US04148829
查看条件与参与物IDENTITY
结构与身份
- 标准 SMILES
- CC1CCCC(C)(C)C1=O
- InChIKey
- ZPVOLGVTNLDBFI-UHFFFAOYSA-N
- 分子式
- C9H16O
- 平均分子量
- 140.22 g/mol
- 单同位素质量
- 140.12011513
COMPUTED
结构计算性质
- XLogP
- 2.4
- 极性表面积
- 17.1 Ų
- 氢键供体
- 0
- 氢键受体
- 1
- 可旋转键
- 0
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 147
物化、安全与法规信息正在同步。
ALIASES
名称与别名
2,2,6-TRIMETHYLCYCLOHEXANONE2408-37-92,2,6-Trimethylcyclohexan-1-oneCyclohexanone, 2,2,6-trimethyl-2,6,6-Trimethylcyclohexanone1,1,3-Trimethyl-2-cyclohexanoneFEMA No. 3473CQ3ZL1YW7R2,6,6-Trimethylcyclohexan-1-oneEINECS 219-309-9NSC 401659NSC-401659DTXSID208629252,2,6-TRIMETHYLCYCLOHEXANONE [FHFI]RefChem:4407962,6,6Trimethylcyclohexanone1,1,3Trimethyl2cyclohexanone2,2,6Trimethylcyclohexan1one2,6,6Trimethylcyclohexan1oneCyclohexanone, 2,2,6trimethyl
REACTIONS
参与反应
HRID196525
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看条件与参与物HRID280423
uspto-grants-1986_05
作为反应物
uspto-grants-1986_05 · 10.6084/m9.figshare.5104873.v1 · US04588849
查看条件与参与物HRID280424
uspto-grants-1986_05
作为反应物
uspto-grants-1986_05 · 10.6084/m9.figshare.5104873.v1 · US04588849
查看条件与参与物HRID298757
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
查看条件与参与物HRID371964
uspto-grants-1978_05
作为反应物
uspto-grants-1978_05 · 10.6084/m9.figshare.5104873.v1 · US04088681
查看条件与参与物HRID371965
uspto-grants-1978_05
作为反应物
uspto-grants-1978_05 · 10.6084/m9.figshare.5104873.v1 · US04088681
查看条件与参与物HRID1141730
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D
查看条件与参与物