2-Amino-3-pyridinecarboxaldehyde 2-氨基-3-吡啶甲醛

CAS 7521-41-7 MFCD01830382

化学结构图

7521-41-7
SMILES: Nc1ncccc1C=O

化学属性

Mol. FormulaC6H6N2O
Mol. Weight122.12
Melting Point98-102°C
Density1.264
TSCANo
Solubility不溶
Appearance 淡黄色固体
Boiling Point290.7±25.0 °C at 760 mmHg

别名和识别编码

Chemical Name2-Amino-3-pyridinecarboxaldehyde
CAS Number7521-41-7
Alfabeta NameAMINONICOTINALDEHYDE 2-
MDL NumberMFCD01830382
EC Number000-000-0
Beilstein Registry Number22(5)12,542
PubChem Substance ID737633
Synonym 2-Aminonicotinaldehyde {LY} 2-Aminonicotinaldehyde {} {LY} 2-Aminonicotinaldehyde {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Aminonicotinaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {
Chemical Name Translation2-氨基-3-吡啶甲醛
Reaxys-RN109598
InChIKeyNXMFJCRMSDRXLD-UHFFFAOYSA-N
LabNetwork Molecule IDLN00008768
InChIInChI=1S/C6H6N2O/c7-6-5(4-9)2-1-3-8-6/h1-4H,(H2,7,8)
Canonical SMILESO=CC1=C(N)N=CC=C1
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分类

  • {SNA} Aldehydes, Building Blocks, C1 to C6, C6, Carbonyl Compounds, Chemical Synthesis, Heterocyclic Building Blocks, Organic Building Blocks, Pyridines
  • {KO} Aldehydes
  • {KO} AminesPrimary

相关文献及参考

  • Beilstein:22(5)12,542

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
  • 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;
  • S37 Wear suitable gloves 戴适当手套;
Risk Statements
  • 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
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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • 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
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Storage condition -20°C, protect from light, stored under nitrogen {LY} -20°C, protect from light, stored under nitrogen 0-10 0-10°C Air Sensitive Refrigerator (+4°C) {} {LY} -20°C, protect from light, stored under nitrogen {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored
Hazard Codes Xn Xi Xi,Xn
Packing GroupII

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
1
LogP
7.904999999999999e-001

其他信息

  • TCI Shanghai:2-氨基-3-吡啶甲醛 2-Aminonicotinaldehyde,>;97.0%(GC)(7521-41-7)
  • MOL 文件:7521-41-7.mol
  • Sigma Aldrich:7521-41-7(sigmaaldrich)
  • 检测方法:HPLC
  • 不溶于水。
  • Hazard Note:Irritant
  • 2-氨基-3-吡啶甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xp300055 2-氨基-3-醛基吡啶 1g 138元 2011/04/16 A1818 2-氨基-3-吡啶甲醛 2-Aminonicotinaldehyde 5G 3260元 2011/04/16 A1818 2-氨基-3-吡啶甲醛 2-Aminonicotinaldehyde 1G 1070元
  • 敏感性:Air Sensitive
  • Acros Organics:2-氨基-3-吡啶甲醛 2-Amino-3-pyridinecarboxaldehyde, 97%(7521-41-7)
  • Alfa Aesar:2-氨基吡啶-3-甲醛,98% 2-Aminopyridine-3-carboxaldehyde, 98%(7521-41-7)
  • 存储注意事项:空气敏感

系列性分类


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