Home Aldehydes 94-21-3
94-21-3,MFCD00021067
Catalog No.:AA003KHO

94-21-3 | 4-[(2-Cyanoethyl)methylamino]benzaldehyde

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003KHO
Chemical Name:
4-[(2-Cyanoethyl)methylamino]benzaldehyde
CAS Number:
94-21-3
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD00021067
SMILES:
O=Cc1ccc(cc1)N(CCC#N)C
Properties
Properties
 
BP:
387.1 °C at 760 mmHg  
Form:
Solid  
MP:
70-74 °C  
Storage:
2-8℃;Light sensitive;Inert atmosphere;  

Computed Properties
 
Complexity:
223  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
4  
XLogP3:
1.2  

Downstream Synthesis Route

[1]Patent:DE721020,1935,    DRP/DRBPOrg.Chem.,

2026-42-8    94-21-3   
Methyl-4-((E)-2-thiophen-2-yl-vinyl)-phenyl-amine 

[1]TetrahedronLetters,2004,vol.45,p.1473-1475

2026-42-8    94-21-3   
Methyl-4-((E)-2-thiophen-2-yl-vinyl)-phenyl-amine 
 
3-{Methyl-4-((E)-2-thiophen-2-yl-vinyl)-phenyl-amino}-propionitrile 

[1]TetrahedronLetters,2004,vol.45,p.1473-1475

94-21-3    1078-28-0    141-43-5   
1-(2-Amino-ethyl)-2-((E)-2-{4-(2-cyano-ethyl)-methyl-amino-phenyl}-vinyl)-6-methoxy-quinolinium 

[1]AngewandteChemie-InternationalEdition,2004,vol.43,p.6331-6335

[1]Locationinpatent:experimentalpartHong,MyengChan;Kim,YunKyung;Choi,JaeYong;Yang,SiQiang;Rhee,Hakjune;Ryu,YoungHoon;Choi,TaeHyun;Cheon,GiJeong;An,GwangIl;Kim,HyeYun;Kim,Youngsoo;Kim,DongJin;Lee,Jun-Seok;Chang,Young-Tae;Lee,KyoChul[BioorganicandMedicinalChemistry,2010,vol.18,#22,p.7724-7730]

Literature

Title: Structural characterization of pyrrolic cross-links in collagen using a biotinylated Ehrlich's reagent.

Journal: The Journal of biological chemistry 20010601

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Tags:94-21-3 Molecular Formula|94-21-3 MDL|94-21-3 SMILES|94-21-3 4-[(2-Cyanoethyl)methylamino]benzaldehyde