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4386-07-6,MFCD00152061
Catalog No.:AA01AD81

4386-07-6 | 2-cyano-2-ethylbutanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$90.00   $63.00
- +
1g
95%
in stock  
$240.00   $168.00
- +
5g
95%
in stock  
$835.00   $584.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01AD81
Chemical Name:
2-cyano-2-ethylbutanoic acid
CAS Number:
4386-07-6
Molecular Formula:
C7H11NO2
Molecular Weight:
141.1677
MDL Number:
MFCD00152061
SMILES:
CCC(C(=O)O)(C#N)CC
Properties
Computed Properties
 
Complexity:
173  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.3  

Downstream Synthesis Route

[1]Hesse,B.C.[AmericanChemicalJournal,1896,vol.18,p.748]

[1]Hesse[AmericanChemicalJournal,1896,vol.18,p.749]

[1]Bowden[JournaloftheAmericanChemicalSociety,1938,vol.60,p.131]

[2]CurrentPatentAssignee:Hoering;Baum-DE186739,1800,C

[3]CurrentPatentAssignee:Hoering;Baum-DE186739,1800,C

[1]CurrentPatentAssignee:MERCKKGAA-DE597305,1931,C[Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.19,p.1507][Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.19,p.1507]

[1]Schroeteretal.[ChemischeBerichte,1932,vol.65,p.432,441]

[2]CurrentPatentAssignee:MERCKKGAA-DE597305,1931,C[Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.19,p.1507][Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.19,p.1507]

Literature
Quotation Request
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SDS
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Tags:4386-07-6 Molecular Formula|4386-07-6 MDL|4386-07-6 SMILES|4386-07-6 2-cyano-2-ethylbutanoic acid
Catalog No.: AA01AD81
4386-07-6,MFCD00152061
4386-07-6 | 2-cyano-2-ethylbutanoic acid
Pack Size： 250mg
Purity： 95%
in stock
$90.00 $63.00
Pack Size： 1g
Purity： 95%
in stock
$240.00 $168.00
Pack Size： 5g
Purity： 95%
in stock
$835.00 $584.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01AD81
Chemical Name: 2-cyano-2-ethylbutanoic acid
CAS Number: 4386-07-6
Molecular Formula: C7H11NO2
Molecular Weight: 141.1677
MDL Number: MFCD00152061
SMILES: CCC(C(=O)O)(C#N)CC
Properties
Complexity: 173  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.3  
Downstream Synthesis Route
28118-33-4    4386-07-6 

[1]Hesse,B.C.[AmericanChemicalJournal,1896,vol.18,p.748]

4386-07-6    88-09-5 

[1]Hesse[AmericanChemicalJournal,1896,vol.18,p.749]

4386-07-6    617-80-1 

[1]Bowden[JournaloftheAmericanChemicalSociety,1938,vol.60,p.131]

[2]CurrentPatentAssignee:Hoering;Baum-DE186739,1800,C

[3]CurrentPatentAssignee:Hoering;Baum-DE186739,1800,C

4386-07-6    44865-11-4 

[1]CurrentPatentAssignee:MERCKKGAA-DE597305,1931,C[Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.19,p.1507][Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.19,p.1507]

4386-07-6    89728-30-3 

[1]Schroeteretal.[ChemischeBerichte,1932,vol.65,p.432,441]

[2]CurrentPatentAssignee:MERCKKGAA-DE597305,1931,C[Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.19,p.1507][Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.19,p.1507]

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