Home Other Building Blocks Ethyl 6-formylnicotinate

Ethyl 6-formylnicotinate

CAS No.:
20857-31-2
Catalog Number:
AG002JRT
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG002JRT
Chemical Name:
Ethyl 6-formylnicotinate
CAS Number:
20857-31-2
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
MDL Number:
MFCD19690524
IUPAC Name:
ethyl 6-formylpyridine-3-carboxylate
InChI:
InChI=1S/C9H9NO3/c1-2-13-9(12)7-3-4-8(6-11)10-5-7/h3-6H,2H2,1H3
InChI Key:
LFOIOKMHVHLARR-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(nc1)C=O
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties