2-Oxo-4-(2-thienyl)-1,2-dihydro-3-pyridinecarbonitrile

CAS N/A MFCD03001295

化学结构图

N/A
SMILES: N#CC1C(=O)NC=CC=1C1=CC=CS1

化学属性

Mol. FormulaC10H6N2OS
Mol. Weight202.23
Melting Point291-293°

别名和识别编码

Chemical Name2-oxo-4-(2-thienyl)-1,2-dihydro-3-pyridinecarbonitrile
Alfabeta NameOXOTHIENYLDIHYDROPYRIDINECARBONITRILE 242123()--------,
MDL NumberMFCD03001295
Synonym 2-oxo-4-(2-thienyl)-1,2-dihydro-3-pyridinecarbonitrile
PubChem Substance ID329791031

分类

  • Building Blocks, C10, C10 to C20+, Chemical Synthesis, Heterocyclic Building Blocks, New Products for Chemical Synthesis, Pyridines, Thiophenes
  • {KO} Nitriles
  • {SNA} Building Blocks, C10, C10 to C20+, Chemical Synthesis, Heterocyclic Building Blocks, Pyridines, Thiophenes

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
Precautionary statements
  • 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
  • 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；
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
Hazard statements
  • H318 Causes serious eye damage 严重伤害眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H315 Causes skin irritation 会刺激皮肤
  • H302 Harmful if swallowed 吞食有害
Hazard Codes Xn
Risk Statements
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害

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
2
Rotatable Bonds
1
LogP
3.024000000000000e-001

系列性分类

  1. C10 - Pyridines
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Thiophenes 噻吩
  5. C10 to C20+ - Thiophenes

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