Home Other Building Blocks 6-CYANO-3-METHYL-PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER

6-CYANO-3-METHYL-PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER

CAS No.:
1427423-59-3
Catalog Number:
AG01BWYK
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BWYK
Chemical Name:
6-CYANO-3-METHYL-PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER
CAS Number:
1427423-59-3
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD23706752
IUPAC Name:
methyl 6-cyano-3-methylpyridine-2-carboxylate
InChI:
InChI=1S/C9H8N2O2/c1-6-3-4-7(5-10)11-8(6)9(12)13-2/h3-4H,1-2H3
InChI Key:
WSSXMHWFUBRWDR-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc(C#N)ccc1C
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties