3-(Trifluoromethyl)Isonicotinic Acid 3-(三氟甲基)异烟酸
CAS 590371-38-3 MFCD08234940
化学结构图
SMILES: OC(=O)C1C=CN=CC=1C(F)(F)F
化学属性
| Mol. Formula | C7H4F3NO2 |
|---|---|
| Mol. Weight | 191.11 |
| Melting Point | 214-215° |
| Density | |
| Boiling Point |
别名和识别编码
| Chemical Name | 3-(Trifluoromethyl)Isonicotinic Acid |
|---|---|
| CAS Number | 590371-38-3 |
| Alfabeta Name | TRIFLUOROMETHYLPYRIDINECARBOXYLICACID 34()--- |
| MDL Number | MFCD08234940 |
| Synonym | 3-(trifluoromethyl)isonicotinic acid |
| EC Number | |
| Beilstein Registry Number | |
| Chemical Name Translation | 3-(三氟甲基)异烟酸 |
| PubChem Substance ID | 329789335 |
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资金保障
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现货库存
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分类
- {SNA} Building Blocks, C7, Chemical Synthesis, Heterocyclic Building Blocks, Pyridines
- {KO} CarboxylicAcids
安全信息
GHS Symbol
- P301 IF SWALLOWED: 如果吞下去
- 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
- H301 Toxic if swallowed 吞食有毒
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
1
H-bond Donors
1
LogP
1
