Name: Name:2-Cyano-4-pyridine carboxylic acid methyl ester
Brand: AABLOCKS
SKU: AA00H7HL
Rating: 90 (10 reviews)

Catalog No.: AA00H7HL

94413-64-6 | 2-Cyano-4-pyridine carboxylic acid methyl ester

Pack Size： 1g

Purity： 98%

in stock

$11.00 $8.00

Pack Size： 5g

Purity： 98%

in stock

$15.00 $11.00

Pack Size： 10g

Purity： 98%

in stock

$19.00 $13.00

Pack Size： 25g

Purity： 98%

in stock

$41.00 $29.00

Pack Size： 100g

Purity： 96%

in stock

$132.00 $93.00

Pack Size： 500g

Purity： 96%

in stock

$615.00 $430.00

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Technical Information

Catalog Number: AA00H7HL

Chemical Name: 2-Cyano-4-pyridine carboxylic acid methyl ester

CAS Number: 94413-64-6

Molecular Formula: C8H6N2O2

Molecular Weight: 162.1454

MDL Number: MFCD07367894

SMILES: COC(=O)c1ccnc(c1)C#N

Properties

BP: 296.6°C at 760 mmHg

Form: Solid

MP: 107 - 109 °C

Storage: Inert atmosphere;Room Temperature;

Complexity: 218

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: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 0.8

Upstream Synthesis Route

557-21-1

26156-48-9

94413-64-6

[1]Patent:US9139612,2015,B2,.Locationinpatent:Page/Pagecolumn153;154;159

[2]Patent:US2017/100390,2017,A1,.Locationinpatent:Paragraph1104

[3]Patent:WO2018/170465,2018,A1,.Locationinpatent:Paragraph248

773837-37-9

3783-38-8

94413-64-6

[1]Patent:CN104151297,2016,B,.Locationinpatent:Paragraph0039;0040

[2]JournalofMedicinalChemistry,2009,vol.52,#10,p.3385-3396

3783-38-8

748101-41-9

94413-64-6

[1]Patent:CN104151297,2016,B,.Locationinpatent:Paragraph0037;0038

3783-38-8

7677-24-9

94413-64-6

[1]Patent:WO2013/127268,2013,A1,.Locationinpatent:Page/Pagecolumn71;72

[2]Patent:EP2533783,2015,B1,.Locationinpatent:Paragraph0425-0426

[3]Tetrahedron,2018,vol.74,#25,p.3165-3170

3783-38-8

94413-64-6

[1]Patent:CN104151297,2016,B,.Locationinpatent:Paragraph0041;0042

Downstream Synthesis Route

94413-64-6

94413-69-1

[1]Patent:WO2013/127268,2013,A1.Locationinpatent:Page/Pagecolumn71;72

[2]Patent:US2003/236264,2003,A1.Locationinpatent:Page51

[3]Patent:US2017/100390,2017,A1.Locationinpatent:Paragraph1102;1105

[4]Patent:WO2018/170465,2018,A1.Locationinpatent:Paragraph249

94413-64-6

135048-32-7

[1]Patent:CN107573330,2018,A.Locationinpatent:Paragraph0028;0029;0030;0031;0047;0049;0050-0063

[2]Patent:CN104151297,2016,B.Locationinpatent:Paragraph0047;0048

[3]Patent:EP1471065,2004,A1.Locationinpatent:Page8

[4]Patent:CN107652271,2018,A.Locationinpatent:Paragraph0065-0074

3783-38-8

94413-64-6

[1]Patent:EP1471065,2004,A1.Locationinpatent:Page7

3783-38-8

7677-24-9

79-44-7

94413-64-6

[1]Patent:US6509361,2003,B1

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