3-(Trifluoromethyl)pyridine-2-thiol 2-巯基-3-三氟甲基吡啶

CAS 104040-74-6 MFCD00178749

化学结构图

104040-74-6
SMILES: FC(F)(F)C1=CC=CN=C1S

化学属性

Mol. FormulaC6H4F3NS
Mol. Weight179.16
Melting Point178-183 °C

别名和识别编码

Chemical Name3-(Trifluoromethyl)pyridine-2-thiol
CAS Number104040-74-6
Alfabeta NameTRIFLUOROMETHYLPYRIDINETHIOL 32()---
MDL NumberMFCD00178749
Synonym 2-mercapto-3-(trifluoromethyl)pyridine 3-(Trifluoromethyl)-2-mercaptopyridine
PubChem Substance ID329785236
Chemical Name Translation2-巯基-3-三氟甲基吡啶
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分类

  • {SNA} Building Blocks, C6, Chemical Synthesis, Heterocyclic Building Blocks, Pyridines
  • {KO} Thiols

安全信息

Warnings IRRITANT
Hazard Codes T
Safety Statements
  • 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）；
GHS Symbol
WGK Germany3
Precautionary statements
  • P301+P310
  • P305+P351+P338
Hazard statements
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H301 Toxic if swallowed 吞食有毒
Signal word Danger
Risk Statements
  • R25 Toxic if swallowed 吞咽有毒
  • R36 Irritating to eyes 刺激眼睛

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 Acceptors
1
Rotatable Bonds
0
H-bond Donors
1
LogP
2

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物
  1. C6 - Pyridines

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