4-[4-(2-Hydroxyethyl)-3-methyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl]benzenecarboxylic acid
CAS N/A MFCD03848421
化学结构图
SMILES: CC1NN(C(=O)C=1CCO)C1C=CC(=CC=1)C(O)=O
化学属性
| Mol. Formula | C13H14N2O4 |
|---|---|
| Mol. Weight | 262.27 |
| Melting Point | 237-239° |
别名和识别编码
| Chemical Name | 4-[4-(2-Hydroxyethyl)-3-methyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl]benzenecarboxylic acid |
|---|---|
| Alfabeta Name | HYDROXYETHYLMETHYLOXODIHYDROPYRAZOLYLBENZENECARBOXYLICACID H442352511[]()-------------, |
| MDL Number | MFCD03848421 |
分类
- {KO} CarboxylicAcids
- {KO} AminesSecondaryHeteroNH
- {KO} Alcohols
安全信息
药物吸收、分布、代谢与排泄(ADME)
H-bond Donors
3
H-bond Acceptors
4
Rotatable Bonds
4
