Methyl 5-Bromo-2-(methylthio)-4-pyrimidinecarboxylate 2-甲硫基-5-溴-4-嘧啶甲酸甲酯
CAS 50593-91-4 MFCD05664428
化学结构图
SMILES: COC(=O)C1N=C(N=CC=1Br)SC
化学属性
| Mol. Formula | C7H7BrN2O2S |
|---|---|
| Mol. Weight | 263.12 |
| Melting Point | 68-70° |
| Density | 1.422 |
别名和识别编码
| Chemical Name | Methyl 5-Bromo-2-(methylthio)-4-pyrimidinecarboxylate |
|---|---|
| CAS Number | 50593-91-4 |
| Alfabeta Name | METHYLBROMOMETHYLSULFANYLPYRIMIDINECARBOXYLATE 524()----- |
| MDL Number | MFCD05664428 |
| EC Number | 250-023-7 |
| Beilstein Registry Number | 2384789 |
| Chemical Name Translation | 2-甲硫基-5-溴-4-嘧啶甲酸甲酯 |
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分类
- {KO} Esters
安全信息
GHS Symbol
- 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；
- S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- 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
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
0
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