2-Chloro-3-pyridinecarboxaldehyde 2-氯-3-甲酰基吡啶(2-氯烟醛)

CAS 36404-88-3 MFCD01315308

化学结构图

36404-88-3
SMILES: O=CC1C=CC=NC=1Cl

化学属性

Mol. FormulaC6
Mol. Weight142
Melting Point50-54
Flash Point>110°(230°F)
TSCANo
Density1.332

别名和识别编码

Chemical Name2-Chloro-3-pyridinecarboxaldehyde
CAS Number36404-88-3
Alfabeta NameCHLORONICOTINALDEHYDE 2-
MDL NumberMFCD01315308
Synonym 2-氯-3-吡啶甲醛 2-Chloro-3-pyridinecarboxaldehyde 氯-2-甲酰基-3-吡啶 2-氯吡啶-3-甲醛 2-Chloro-3-formylpyridine
PubChem Substance ID125307940
Chemical Name Translation2-氯-3-甲酰基吡啶(2-氯烟醛)
Reaxys-RN386019
Beilstein Registry Number386019
LabNetwork Molecule IDLN00004074
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分类

  • {KO} ReacChlorides
  • {SNA} Aldehydes, Building Blocks, C1 to C6, C6, Carbonyl Compounds, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Organic Building Blocks, Pyridines
  • Heterocycles
  • Miscellaneous Reagents
  • Aromatics
  • {KO} Aldehydes

产品应用

  • Hemetsberger-Knittel反应制备 5-氮杂吲哚(5-azaindoles)的起始物质。

相关文献及参考

  • Leon, C., et al.: Eur. J. Med. Chem., 42, 735 (2007),

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • P302+P350
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+P313
  • P337+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
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；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36 Irritating to eyes 刺激眼睛
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
Hazard Codes Xn

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
2
Rotatable Bonds
1
H-bond Donors
0
LogP
1

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aldehydes - Carbonyl Compounds
  6. C1 to C6 - Aldehydes
  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. Halogenated Heterocycles 卤代杂环
  5. Pyridines - Halogenated Heterocycles
  1. C6 - 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. Pyridines 吡啶

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