1-(tert-Butyl) 4-ethyl 5-(trifluoromethyl)-1H-pyrazole-1,4-dicarboxylate
CAS N/A MFCD08689692
化学结构图
SMILES: CC(C)(C)OC(=O)N1N=CC(C(=O)OCC)=C1C(F)(F)F
化学属性
| Mol. Formula | C12H15F3N2O4 |
|---|---|
| Mol. Weight | 308.26 |
| Melting Point | 107-108° |
别名和识别编码
| Chemical Name | 1-(tert-Butyl) 4-ethyl 5-(trifluoromethyl)-1H-pyrazole-1,4-dicarboxylate |
|---|---|
| Alfabeta Name | BUTYLETHYLTRIFLUOROMETHYLPYRAZOLEDICARBOXYLATE TERTH145114(())--------, |
| MDL Number | MFCD08689692 |
分类
- {KO} Esters
- {KO} tBocN
安全信息
药物吸收、分布、代谢与排泄(ADME)
Lipinski's Rule of 5
Y
H-bond Acceptors
5
Rotatable Bonds
5
H-bond Donors
0
LogP
2
