4-benzylthio-3-nitrobenzaldehyde
CAS 175278-44-1 MFCD00173710
化学结构图
SMILES: [O-][N+](=O)C1C=C(C=CC=1SCC1C=CC=CC=1)C=O
化学属性
| Mol. Formula | C14H11NO3S |
|---|---|
| Mol. Weight | 273.31 |
| Melting Point | 170-172° |
别名和识别编码
| Chemical Name | 4-benzylthio-3-nitrobenzaldehyde |
|---|---|
| CAS Number | 175278-44-1 |
| Alfabeta Name | BENZYLSULFANYLNITROBENZENECARBALDEHYDE 43()--- |
| MDL Number | MFCD00173710 |
| Synonym | 4-benzylthio-3-nitrobenzaldehyde |
| Chemical Name Translation |
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分类
- {SNA} Building Blocks, Chemical Synthesis, Nitro Compounds, Nitrogen Compounds, Nitroso Compounds, Organic Building Blocks, Sulfides/Disulfides, Sulfur Compounds
安全信息
药物吸收、分布、代谢与排泄(ADME)
H-bond Donors
0
H-bond Acceptors
3
Lipinski's Rule of 5
Y
LogP
3
Rotatable Bonds
4
