181123-11-5,MFCD06657552
Catalog No.:AA0022M9

181123-11-5 | 5-Chloro-3-nitropyridine-2-carbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$13.00   $9.00
- +
5g
98%
in stock  
$21.00   $15.00
- +
10g
98%
in stock  
$32.00   $23.00
- +
25g
98%
in stock  
$65.00   $46.00
- +
100g
98%
in stock  
$256.00   $179.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0022M9
Chemical Name:
5-Chloro-3-nitropyridine-2-carbonitrile
CAS Number:
181123-11-5
Molecular Formula:
C6H2ClN3O2
Molecular Weight:
183.5520
MDL Number:
MFCD06657552
SMILES:
[O-][N+](=O)c1cc(Cl)cnc1C#N
NSC Number:
141226
Properties
Properties
 
BP:
329.5°C at 760 mmHg  
Form:
Solid  
MP:
98°C  
Storage:
Inert atmosphere;Room Temperature;  

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:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.4  

Upstream Synthesis Route

[1]Patent:WO2017/125534,2017,A1,.Locationinpatent:Page/Pagecolumn318

[1]BioorganicandMedicinalChemistry,2001,vol.9,#8,p.2061-2071

[2]Patent:WO2006/76644,2006,A2,.Locationinpatent:Page/Pagecolumn173-174

[3]Patent:WO2009/9740,2009,A1,.Locationinpatent:Page/Pagecolumn54-55

[1]Patent:WO2005/97805,2005,A1,.Locationinpatent:Page/Pagecolumn57-58

[1]Patent:US5801183,1998,A,

[1]BioorganicandMedicinalChemistry,2001,vol.9,#8,p.2061-2071

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,1952,p.2042,2044

[1]JournaloftheChemicalSociety,1952,p.2042,2044

[1]BioorganicandMedicinalChemistry,2001,vol.9,p.2061-2071

[2]Patent:WO2006/76644,2006,A2.Locationinpatent:Page/Pagecolumn173-174

[3]Patent:WO2009/9740,2009,A1.Locationinpatent:Page/Pagecolumn54-55

[1]BioorganicandMedicinalChemistry,2001,vol.9,p.2061-2071

[2]JournaloftheChemicalSociety,1952,p.2042,2044

[3]Patent:US2014/213581,2014,A1.Locationinpatent:Paragraph0627

[4]Patent:WO2014/138484,2014,A1.Locationinpatent:Page/Pagecolumn144;145

[5]Patent:US2015/38497,2015,A1.Locationinpatent:Paragraph0791

[6]Patent:WO2016/22724,2016,A1.Locationinpatent:Page/Pagecolumn261

[7]Patent:WO2019/170543,2019,A1

[1]BioorganicandMedicinalChemistry,2001,vol.9,p.2061-2071

Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Related Products of 181123-11-5
Tags:181123-11-5 Molecular Formula|181123-11-5 MDL|181123-11-5 SMILES|181123-11-5 5-Chloro-3-nitropyridine-2-carbonitrile
Catalog No.: AA0022M9
181123-11-5,MFCD06657552
181123-11-5 | 5-Chloro-3-nitropyridine-2-carbonitrile
Pack Size: 1g
Purity: 98%
in stock
$13.00 $9.00
Pack Size: 5g
Purity: 98%
in stock
$21.00 $15.00
Pack Size: 10g
Purity: 98%
in stock
$32.00 $23.00
Pack Size: 25g
Purity: 98%
in stock
$65.00 $46.00
Pack Size: 100g
Purity: 98%
in stock
$256.00 $179.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0022M9
Chemical Name: 5-Chloro-3-nitropyridine-2-carbonitrile
CAS Number: 181123-11-5
Molecular Formula: C6H2ClN3O2
Molecular Weight: 183.5520
MDL Number: MFCD06657552
SMILES: [O-][N+](=O)c1cc(Cl)cnc1C#N
NSC Number: 141226
Properties
BP: 329.5°C at 760 mmHg  
Form: Solid  
MP: 98°C  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 231  
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: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.4  
Upstream Synthesis Route
75806-86-9    181123-11-5 

[1]Patent:WO2017/125534,2017,A1,.Locationinpatent:Page/Pagecolumn318

75806-86-9    544-92-3    181123-11-5 

[1]BioorganicandMedicinalChemistry,2001,vol.9,#8,p.2061-2071

[2]Patent:WO2006/76644,2006,A2,.Locationinpatent:Page/Pagecolumn173-174

[3]Patent:WO2009/9740,2009,A1,.Locationinpatent:Page/Pagecolumn54-55

21427-62-3    544-92-3    181123-11-5 

[1]Patent:WO2005/97805,2005,A1,.Locationinpatent:Page/Pagecolumn57-58

75806-86-9    181123-11-5 

[1]Patent:US5801183,1998,A,

1072-98-6    181123-11-5 

[1]BioorganicandMedicinalChemistry,2001,vol.9,#8,p.2061-2071

Downstream Synthesis Route
181123-11-5    856834-36-1 

[1]JournaloftheChemicalSociety,1952,p.2042,2044

75806-86-9   
CuCN 
  181123-11-5 

[1]JournaloftheChemicalSociety,1952,p.2042,2044

75806-86-9    544-92-3    181123-11-5 

[1]BioorganicandMedicinalChemistry,2001,vol.9,p.2061-2071

[2]Patent:WO2006/76644,2006,A2.Locationinpatent:Page/Pagecolumn173-174

[3]Patent:WO2009/9740,2009,A1.Locationinpatent:Page/Pagecolumn54-55

181123-11-5    27330-34-3 

[1]BioorganicandMedicinalChemistry,2001,vol.9,p.2061-2071

[2]JournaloftheChemicalSociety,1952,p.2042,2044

[3]Patent:US2014/213581,2014,A1.Locationinpatent:Paragraph0627

[4]Patent:WO2014/138484,2014,A1.Locationinpatent:Page/Pagecolumn144;145

[5]Patent:US2015/38497,2015,A1.Locationinpatent:Paragraph0791

[6]Patent:WO2016/22724,2016,A1.Locationinpatent:Page/Pagecolumn261

[7]Patent:WO2019/170543,2019,A1

1072-98-6    181123-11-5 

[1]BioorganicandMedicinalChemistry,2001,vol.9,p.2061-2071

Building Blocks More >
18163-42-3
18163-42-3
Propanoic acid, 2-(dichloromethylsilyl)-, methyl ester
AA0022WK | MFCD00039293
18202-10-3
18202-10-3
11-Dodecyn-1-ol
AA00236U | MFCD07780248
182287-63-4
182287-63-4
4-(Bromomethyl)-3-iodobenzonitrile
AA0023HR | MFCD16872046
18259-05-7
18259-05-7
1,1'-Biphenyl, 2,3,4,5,6-pentachloro-
AA0023WY | MFCD00152724
183059-24-7
183059-24-7
tert-Butyl 2-hydroxy-2-methylpropylcarbamate
AA0024AM | MFCD09608009
1765-93-1
1765-93-1
4-Fluorophenylboronic acid
AA0024N3 | MFCD00039136
176969-34-9
176969-34-9
3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid
AA0024Y3 | MFCD11865267
1774-36-3
1774-36-3
4,4'-Dimethoxy diphenylsulfoxide
AA002581 | MFCD08443609
1778-08-1
1778-08-1
2-Hydroxy-n,n-dimethylbenzamide
AA0025HT | MFCD00456946
178172-34-4
178172-34-4
1H-Azepine-1-carboxylic acid, hexahydro-2-hydroxy-, 1,1-dimethylethyl ester
AA0025QD | MFCD09031187
Submit
© 2017 AA BLOCKS, INC. All rights reserved.