211678-96-5,MFCD03411706
Catalog No.:AA00C443

211678-96-5 | 3-Chloropyridine-4-carboxylic acid ethyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$8.00   $6.00
- +
5g
95%
in stock  
$32.00   $23.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00C443
Chemical Name:
3-Chloropyridine-4-carboxylic acid ethyl ester
CAS Number:
211678-96-5
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
MDL Number:
MFCD03411706
SMILES:
CCOC(=O)c1ccncc1Cl
Properties
Properties
 
BP:
250.2°C at 760 mmHg  
Form:
Liquid  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
163  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.7  

Upstream Synthesis Route

[1]Patent:WO2008/24724,2008,A1,.Locationinpatent:Page/Pagecolumn68-69

[1]Patent:US2014/163035,2014,A1,.Locationinpatent:Page/Pagecolumn

[1]Patent:WO2013/14587,2013,A1,.Locationinpatent:Page/Pagecolumn69

Downstream Synthesis Route

[1]Patent:WO2008/24724,2008,A1.Locationinpatent:Page/Pagecolumn68-69

[1]Patent:WO2008/24724,2008,A1.Locationinpatent:Page/Pagecolumn69

[1]Patent:WO2013/14587,2013,A1.Locationinpatent:Page/Pagecolumn69

[1]Patent:WO2013/164769,2013,A1.Locationinpatent:Page/Pagecolumn52-53

[1]Patent:US2014/163035,2014,A1.Locationinpatent:Page/Pagecolumn

Literature
Quotation Request
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Additional Info:
SDS
Tags:211678-96-5 Molecular Formula|211678-96-5 MDL|211678-96-5 SMILES|211678-96-5 3-Chloropyridine-4-carboxylic acid ethyl ester
Catalog No.: AA00C443
211678-96-5,MFCD03411706
211678-96-5 | 3-Chloropyridine-4-carboxylic acid ethyl ester
Pack Size: 1g
Purity: 95%
in stock
$8.00 $6.00
Pack Size: 5g
Purity: 95%
in stock
$32.00 $23.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00C443
Chemical Name: 3-Chloropyridine-4-carboxylic acid ethyl ester
CAS Number: 211678-96-5
Molecular Formula: C8H8ClNO2
Molecular Weight: 185.6076
MDL Number: MFCD03411706
SMILES: CCOC(=O)c1ccncc1Cl
Properties
BP: 250.2°C at 760 mmHg  
Form: Liquid  
Storage: Keep in dry area;Room Temperature;  
Complexity: 163  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.7  
Upstream Synthesis Route
64-17-5    211678-96-5 

[1]Patent:WO2008/24724,2008,A1,.Locationinpatent:Page/Pagecolumn68-69

88912-27-0    211678-96-5 

[1]Patent:US2014/163035,2014,A1,.Locationinpatent:Page/Pagecolumn

64-17-5    88912-27-0    211678-96-5 

[1]Patent:WO2013/14587,2013,A1,.Locationinpatent:Page/Pagecolumn69

Downstream Synthesis Route
64-17-5    211678-96-5 

[1]Patent:WO2008/24724,2008,A1.Locationinpatent:Page/Pagecolumn68-69

211678-96-5    623-51-8    1008523-91-8 

[1]Patent:WO2008/24724,2008,A1.Locationinpatent:Page/Pagecolumn69

64-17-5    88912-27-0    211678-96-5 

[1]Patent:WO2013/14587,2013,A1.Locationinpatent:Page/Pagecolumn69

211678-96-5    557-20-0    15862-62-1 

[1]Patent:WO2013/164769,2013,A1.Locationinpatent:Page/Pagecolumn52-53

88912-27-0    211678-96-5 

[1]Patent:US2014/163035,2014,A1.Locationinpatent:Page/Pagecolumn

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