HRID6125
uspto-grants-1993_09
作为反应物
uspto-grants-1993_09 · 10.6084/m9.figshare.5104873.v1 · US05246948
查看IDENTITY
结构与身份
- 标准SMILES
- Cc1ccsc1C(=O)O
- InChIKey
- IFLKEBSJTZGCJG-UHFFFAOYSA-N
- 分子式
- C6H6O2S
- 平均分子量
- 142.18 g/mol
- 单同位素质量
- 142.0088506
COMPUTED
结构计算性质
- XLogP
- 1.8
- 极性表面积
- 65.5 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 1
- 重原子
- 9
- 形式电荷
- 0
- 复杂度
- 124
物化、安全与法规信息正在同步。
ALIASES
名称与别名
23806-24-83-Methyl-2-thiophenecarboxylic acid3-Methyl-2-thenoic acid2-Thiophenecarboxylic acid, 3-methyl-EINECS 245-894-5DTXSID20178518RefChem:503725DTXCID80101009245-894-53-Methylthiophene-2-carboxylic acid3-methyl-2-thiophene carboxylic acidMFCD000054382-Carboxy-3-methylthiopheneAC303413-methyl-thiophene-2-carboxylic acid3-methyl-2-thiophenecarboxylic3-Methyl-2-thiophenecarboxylicacid60P3-methyl-2-thienoic acidBIDD:GT0066
REACTIONS
参与反应
HRID13163
uspto-grants-2010_06
作为反应物
uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07728030B2
查看HRID22399
uspto-grants-1995_06
作为反应物
uspto-grants-1995_06 · 10.6084/m9.figshare.5104873.v1 · US05428053
查看HRID145318
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看HRID160933
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看HRID166359
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看HRID171031
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看HRID185569
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