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51632-28-1,MFCD00040893
Catalog No.:AA003L9I

51632-28-1 | 2-(4-Ethylphenyl)acetonitrile

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1g
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$124.00   $87.00
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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:
AA003L9I
Chemical Name:
2-(4-Ethylphenyl)acetonitrile
CAS Number:
51632-28-1
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
MDL Number:
MFCD00040893
SMILES:
CCc1ccc(cc1)CC#N
Properties
Properties
 
BP:
252.8°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
146  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.4  

Downstream Synthesis Route
5381-20-4    51632-28-1   
2-(4-ethyl-phenyl)-3<i>c</i>(?)-benzo<i>b</i>thiophen-3-yl-acrylonitrile 

[1]JournaloftheChemicalSociety,1951,p.255

74533-20-3    51632-28-1    95-92-1   
3-(4-ethyl-phenyl)-3-cyano-2-oxo-propionicacidethylester 
 
3-(2-ethyl-phenyl)-3-cyano-2-oxo-propionicacidethylester 

[1]Skinneretal.[JournaloftheAmericanChemicalSociety,1951,vol.73,p.2230,2232]

[1]OrganicLetters,2007,vol.9,p.3575-3578

[2]TetrahedronAsymmetry,1991,vol.2,p.1041-1052

[3]JournalofMedicinalChemistry,1998,vol.41,p.2243-2251

[1]Sundaresan,ArunKumar;Ramamurthy[OrganicLetters,2007,vol.9,#18,p.3575-3578]

[2]Toone;Jones[TetrahedronAsymmetry,1991,vol.2,#10,p.1041-1052]

[1]Patent:US5574062,1996,A

[2]Patent:US5589506,1996,A

[3]Patent:US5574062,1996,A

Literature
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SDS
Tags:51632-28-1 Molecular Formula|51632-28-1 MDL|51632-28-1 SMILES|51632-28-1 2-(4-Ethylphenyl)acetonitrile