Home Carboxys 2-Pyridinecarboxylic acid, 3-formyl-, methyl ester

2-Pyridinecarboxylic acid, 3-formyl-, methyl ester

CAS No.:
133155-82-5
Catalog Number:
AG0014CU
Molecular Formula:
C8H7NO3
Molecular Weight:
165.1461
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG0014CU
Chemical Name:
2-Pyridinecarboxylic acid, 3-formyl-, methyl ester
CAS Number:
133155-82-5
Molecular Formula:
C8H7NO3
Molecular Weight:
165.1461
MDL Number:
MFCD11100670
IUPAC Name:
methyl 3-formylpyridine-2-carboxylate
InChI:
InChI=1S/C8H7NO3/c1-12-8(11)7-6(5-10)3-2-4-9-7/h2-5H,1H3
InChI Key:
PSXKRBGWRMVIPG-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncccc1C=O
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.043g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.148g/mol
Monoisotopic Mass:
165.043g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties