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75358-90-6,MFCD07368152
Catalog No.:AA005LZI

75358-90-6 | Ethyl 2-cyanonicotinate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$20.00   $14.00
- +
1g
97%
in stock  
$30.00   $21.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA005LZI
Chemical Name:
Ethyl 2-cyanonicotinate
CAS Number:
75358-90-6
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD07368152
SMILES:
CCOC(=O)c1cccnc1C#N
Properties
Properties
 
BP:
327.9°C at 760 mmHg  
Form:
Solid  
MP:
35-40°C  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
231  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.1  

Upstream Synthesis Route

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,#2,p.565-571

[2]Patent:WO2013/102142,2013,A1,.Locationinpatent:Paragraph0141

[3]Patent:WO2013/102145,2013,A1,.Locationinpatent:Paragraph0247

[4]Patent:US2015/344483,2015,A1,.Locationinpatent:Paragraph0474;0475

[1]Patent:WO2013/102145,2013,A1,

[2]Patent:US2015/344483,2015,A1,

[1]Patent:WO2004/46133,2004,A1,.Locationinpatent:Page31

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,#2,p.565-571

[2]Patent:WO2013/102142,2013,A1,.Locationinpatent:Paragraph0141

[3]Patent:WO2013/102145,2013,A1,.Locationinpatent:Paragraph0247

[4]Patent:US2015/344483,2015,A1,.Locationinpatent:Paragraph0474;0475

[1]BulletindesSocietesChimiquesBelges,1980,vol.89,#3,p.205-232

Downstream Synthesis Route

[1]BulletindesSocietesChimiquesBelges,1980,vol.89,p.205-232

[1]Chemicalandpharmaceuticalbulletin,1985,vol.33,p.565-571

[2]Patent:WO2013/102142,2013,A1.Locationinpatent:Paragraph0141

[3]Patent:WO2013/102145,2013,A1.Locationinpatent:Paragraph0247

[4]Patent:US2015/344483,2015,A1.Locationinpatent:Paragraph0474;0475

[1]Patent:WO2004/46133,2004,A1.Locationinpatent:Page31-32

[2]Patent:WO2013/102142,2013,A1.Locationinpatent:Paragraph0142

[3]Patent:WO2013/102145,2013,A1.Locationinpatent:Paragraph0249

[4]Patent:US2015/344483,2015,A1.Locationinpatent:Paragraph0476;0477

[1]Patent:WO2004/46133,2004,A1.Locationinpatent:Page31

[1]TetrahedronLetters,2010,vol.51,p.860-862

Literature
Quotation Request
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SDS
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Tags:75358-90-6 Molecular Formula|75358-90-6 MDL|75358-90-6 SMILES|75358-90-6 Ethyl 2-cyanonicotinate
Catalog No.: AA005LZI
75358-90-6,MFCD07368152
75358-90-6 | Ethyl 2-cyanonicotinate
Pack Size： 250mg
Purity： 97%
in stock
$20.00 $14.00
Pack Size： 1g
Purity： 97%
in stock
$30.00 $21.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA005LZI
Chemical Name: Ethyl 2-cyanonicotinate
CAS Number: 75358-90-6
Molecular Formula: C9H8N2O2
Molecular Weight: 176.1720
MDL Number: MFCD07368152
SMILES: CCOC(=O)c1cccnc1C#N
Properties
BP: 327.9°C at 760 mmHg  
Form: Solid  
MP: 35-40°C  
Storage: Inert atmosphere;2-8℃;  
Complexity: 231  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.1  
Upstream Synthesis Route
14906-63-9    7677-24-9    76196-79-7    75358-90-6 

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,#2,p.565-571

[2]Patent:WO2013/102142,2013,A1,.Locationinpatent:Paragraph0141

[3]Patent:WO2013/102145,2013,A1,.Locationinpatent:Paragraph0247

[4]Patent:US2015/344483,2015,A1,.Locationinpatent:Paragraph0474;0475

614-18-6    76196-79-7    75358-90-6 

[1]Patent:WO2013/102145,2013,A1,

[2]Patent:US2015/344483,2015,A1,

557-21-1    1452-94-4    75358-90-6 

[1]Patent:WO2004/46133,2004,A1,.Locationinpatent:Page31

14906-63-9    7677-24-9    76196-79-7    75358-90-6 

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,#2,p.565-571

[2]Patent:WO2013/102142,2013,A1,.Locationinpatent:Paragraph0141

[3]Patent:WO2013/102145,2013,A1,.Locationinpatent:Paragraph0247

[4]Patent:US2015/344483,2015,A1,.Locationinpatent:Paragraph0474;0475

5860-70-8    541-41-3    75358-90-6 

[1]BulletindesSocietesChimiquesBelges,1980,vol.89,#3,p.205-232

Downstream Synthesis Route
5860-70-8    541-41-3    75358-90-6 

[1]BulletindesSocietesChimiquesBelges,1980,vol.89,p.205-232

14906-63-9    7677-24-9    76196-79-7    75358-90-6 

[1]Chemicalandpharmaceuticalbulletin,1985,vol.33,p.565-571

[2]Patent:WO2013/102142,2013,A1.Locationinpatent:Paragraph0141

[3]Patent:WO2013/102145,2013,A1.Locationinpatent:Paragraph0247

[4]Patent:US2015/344483,2015,A1.Locationinpatent:Paragraph0474;0475

75358-90-6    697739-11-0 

[1]Patent:WO2004/46133,2004,A1.Locationinpatent:Page31-32

[2]Patent:WO2013/102142,2013,A1.Locationinpatent:Paragraph0142

[3]Patent:WO2013/102145,2013,A1.Locationinpatent:Paragraph0249

[4]Patent:US2015/344483,2015,A1.Locationinpatent:Paragraph0476;0477

557-21-1    1452-94-4    75358-90-6 

[1]Patent:WO2004/46133,2004,A1.Locationinpatent:Page31

75358-90-6    106-95-6    1213767-13-5 

[1]TetrahedronLetters,2010,vol.51,p.860-862

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