Home Other Building Blocks 2-Phenyl-nicotinic acid ethyl ester

2-Phenyl-nicotinic acid ethyl ester

CAS No.:
144501-28-0
Catalog Number:
AG001JO2
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001JO2
Chemical Name:
2-Phenyl-nicotinic acid ethyl ester
CAS Number:
144501-28-0
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
MDL Number:
MFCD12828078
IUPAC Name:
ethyl 2-phenylpyridine-3-carboxylate
InChI:
InChI=1S/C14H13NO2/c1-2-17-14(16)12-9-6-10-15-13(12)11-7-4-3-5-8-11/h3-10H,2H2,1H3
InChI Key:
RQHOSUIKZMCYGD-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccnc1c1ccccc1
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.095g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.263g/mol
Monoisotopic Mass:
227.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties