5-(3-Chlorophenoxy)-1,3-dimethyl-1H-pyrazole-4-carbaldehyde
CAS N/A MFCD00215393
化学结构图
SMILES: CC1=NN(C)C(OC2=CC(Cl)=CC=C2)=C1C=O
化学属性
| Mol. Formula | C12H11ClN2O2 |
|---|---|
| Mol. Weight | 250.69 |
| Melting Point | 87-89° |
别名和识别编码
| Chemical Name | 5-(3-Chlorophenoxy)-1,3-dimethyl-1H-pyrazole-4-carbaldehyde |
|---|---|
| Alfabeta Name | CHLOROPHENOXYDIMETHYLPYRAZOLECARBALDEHYDE H531314()--------, |
| MDL Number | MFCD00215393 |
分类
- {KO} Aldehydes
安全信息
药物吸收、分布、代谢与排泄(ADME)
Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
3
Rotatable Bonds
3
H-bond Donors
0
LogP
2
