3-（4-氯基）-2-氰基丙烯酸酯
CAS 20374-46-3 MFCD02317172
化学结构图
SMILES: N#C/C(=C\C1C=CC(Cl)=CC=1)/C(O)=O
化学属性
| Mol. Formula | C10 |
|---|---|
| Mol. Weight | 208 |
| Melting Point | 191-193° |
别名和识别编码
| Chemical Name | 3-(4-Chlorophenyl)-2-cyanoacrylic acid |
|---|---|
| CAS Number | 20374-46-3 |
| Alfabeta Name | CHLOROPHENYLCYANOACRYLICACID 342()---- |
| MDL Number | MFCD02317172 |
| Synonym | (2E)-3-(4-Chlorophenyl)-2-cyano-2-propenoic Acid (E)-2-Cyano-3-(naphthalen-2-yl)acrylic Acid 3-(4-Chlorophenyl)-2-cyanoacrylic Acid (4-Chlorophenyl)-2-cyano-2-propenoic acid 4-Chloro-α-cyanocinnamic acid |
| Beilstein Registry Number | 2616773 |
| Chemical Name Translation |
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信息真实价格透明
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分类
- Alphabetical Listings, Building Blocks, C, C10, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks, Stable Isotopes
- {KO} Nitriles
- {KO} CarboxylicAcids
- {SNA} Alphabetical Listings, Building Blocks, C, C10, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks, Stable Isotopes
相关文献及参考
- Jaskolla, T.W. et al.: Proc. Nat Acad. Sci. U.S.A., 105, 12200 (2008); Jaskolla, T.W. et al.: J. Proteome Res., 8, 3588 (2009); Towers, M.W. et al.: J. Proteome Res., 9, 1931 (2010);
安全信息
GHS Symbol
- P301+P310
- P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
- H332 Harmful if inhaled 吸入有害
- H312 Harmful in contact with skin 皮肤接触有害
- H301 Toxic if swallowed 吞食有毒
- 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）；
- S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
- R25 Toxic if swallowed 吞咽有毒
- R20/21 Harmful by inhalation and in contact with skin 吸入及与皮肤接触有害
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
3
Rotatable Bonds
3
LogP
2
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