4-(Trifluoromethyl)-1H-Pyrazole 4-(三氟甲基)-1H-吡唑
CAS 52222-73-8 MFCD11226572
化学结构图
SMILES: FC(F)(F)C1=CNN=C1
化学属性
| Mol. Formula | C4H3F3N2 |
|---|---|
| Mol. Weight | 136.08 |
| Melting Point | 73-78 °C |
别名和识别编码
| Chemical Name | 4-(Trifluoromethyl)-1H-Pyrazole |
|---|---|
| CAS Number | 52222-73-8 |
| Alfabeta Name | TRIFLUOROMETHYLPYRAZOLE H41()--- |
| MDL Number | MFCD11226572 |
| Synonym | 4-Trifluoromethylpyrazole |
| Chemical Name Translation | 4-(三氟甲基)-1H-吡唑 |
| PubChem Substance ID | 329766358 |
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分类
- {KO} AminesSecondaryHeteroNH
- {SNA} Building Blocks, C3 to C5, Chemical Synthesis, Heterocyclic Building Blocks, Pyrazoles
- {SA} Building Blocks, C3 to C5, Chemical Synthesis, Heterocyclic Building Blocks, New Products for Chemical Synthesis, Pyrazoles
安全信息
GHS Symbol
- P301+P310
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P305+P351+P338
- H315 Causes skin irritation 会刺激皮肤
- H319 Causes serious eye irritation 严重刺激眼睛
- H301 Toxic if swallowed 吞食有毒
- H335 May cause respiratory irritation 可能导致呼吸道刺激
- S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
- S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
- R25 Toxic if swallowed 吞咽有毒
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
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 Donors
1
H-bond Acceptors
1
Rotatable Bonds
0
LogP
1
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