5-Methoxy-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile

CAS N/A MFCD01935988

化学结构图

N/A
SMILES: CN1N=C(C(C#N)=C1OC)C(F)(F)F

化学属性

Mol. FormulaC7H6F3N3O
Mol. Weight205.14
Melting Point36-37°

别名和识别编码

Chemical Name5-methoxy-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile
Alfabeta NameMETHOXYMETHYLTRIFLUOROMETHYLPYRAZOLECARBONITRILE H51314()---------
MDL NumberMFCD01935988
Synonym 5-methoxy-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile
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分类

  • {KO} Nitriles
  • {SNA} Building Blocks, C7 to C8, Chemical Synthesis, Heterocyclic Building Blocks, Pyrazoles

相关文献及参考

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • P301+P310
  • 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
Signal word Danger
Safety Statements
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置;
  • 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;
  • 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;
Hazard Codes T
Risk Statements
  • R25 Toxic if swallowed 吞咽有毒
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性

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
0
H-bond Acceptors
3
Rotatable Bonds
1
LogP
1

系列性分类


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