1-(4-Fluorobenzyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid
CAS 885950-27-6 MFCD06797392
化学结构图
SMILES: CC1=C(N=NN1CC1=CC=C(F)C=C1)C(O)=O
化学属性
| Mol. Formula | C11H10FN3O2 |
|---|---|
| Mol. Weight | 235.21 |
| Melting Point | 203° |
别名和识别编码
| Chemical Name | 1-(4-fluorobenzyl)-5-methyl-1,2,3-triazole-4-carboxylic acid |
|---|---|
| Alfabeta Name | FLUOROBENZYLMETHYLTRIAZOLECARBOXYLICACID H14511234()---------,, |
| MDL Number | MFCD06797392 |
| Synonym | 1-(4-fluorobenzyl)-5-methyl-1,2,3-triazole-4-carboxylic acid |
| CAS Number | 885950-27-6 |
| PubChem Substance ID | 329790270 |
| Chemical Name Translation |
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分类
- {KO} CarboxylicAcids
- {SNA} Building Blocks, Chemical Synthesis, Fluorinated Building Blocks, Halogenated Heterocycles, Heterocyclic Building Blocks, Heterocyclic Fluorinated Building Blocks, Other Fluorinated Heterocycles, Triazoles
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
4
Rotatable Bonds
3
H-bond Donors
1
LogP
2
