5-Methoxy-2-Nitro-4-(Trifluoromethyl)Phenylacetonitrile 5-甲氧基-2-硝基-4-(三氟甲基)苯乙腈
CAS 178896-77-0 MFCD11848554
化学结构图
SMILES: COC1C=C(CC#N)C(=CC=1C(F)(F)F)[N+]([O-])=O
化学属性
| Mol. Formula | C10H7F3N2O3 |
|---|---|
| Mol. Weight | 260 |
| Melting Point | 102-106 °C |
别名和识别编码
| Chemical Name | 5-Methoxy-2-Nitro-4-(Trifluoromethyl)Phenylacetonitrile |
|---|---|
| CAS Number | 178896-77-0 |
| Alfabeta Name | METHOXYNITROTRIFLUOROMETHYLPHENYLACETONITRILE 2524[]()------- |
| MDL Number | MFCD11848554 |
| Synonym | 5-甲氧基-2-硝基-4-(三氟甲基)苄腈 5-甲氧基-2-硝基-4-(三氟甲基)苯乙腈 |
| Chemical Name Translation | 5-甲氧基-2-硝基-4-(三氟甲基)苯乙腈 |
| PubChem Substance ID | 329763601 |
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信息真实价格透明
资金保障
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分类
- {SNA} Building Blocks, C10 to C27, Chemical Synthesis, Cyanides/Nitriles, Nitro Compounds, Nitrogen Compounds, Organic Building Blocks
- {KO} Nitriles
- {KO} Nitros
安全信息
GHS Symbol
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- 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。
- P305+P351+P338
- H332 Harmful if inhaled 吸入有害
- H315 Causes skin irritation 会刺激皮肤
- H302 Harmful if swallowed 吞食有害
- H312 Harmful in contact with skin 皮肤接触有害
- H335 May cause respiratory irritation 可能导致呼吸道刺激
- H319 Causes serious eye irritation 严重刺激眼睛
- S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
- 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；
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
药物吸收、分布、代谢与排泄(ADME)
Lipinski's Rule of 5
Y
H-bond Donors
0
H-bond Acceptors
4
Rotatable Bonds
2
LogP
2
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