Home Other Building Blocks Methyl 5-phenylnicotinate

Methyl 5-phenylnicotinate

CAS No.:
10177-13-6
Catalog Number:
AG0005G4
Molecular Formula:
C13H11NO2
Molecular Weight:
213.2319
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$438
- +
5g
98%
In Stock USA
United States
$1750
- +
Product Description
Catalog Number:
AG0005G4
Chemical Name:
Methyl 5-phenylnicotinate
CAS Number:
10177-13-6
Molecular Formula:
C13H11NO2
Molecular Weight:
213.2319
MDL Number:
MFCD06802742
IUPAC Name:
methyl 5-phenylpyridine-3-carboxylate
InChI:
InChI=1S/C13H11NO2/c1-16-13(15)12-7-11(8-14-9-12)10-5-3-2-4-6-10/h2-9H,1H3
InChI Key:
CJXJQNNSSJBPBF-UHFFFAOYSA-N
SMILES:
COC(=O)c1cncc(c1)c1ccccc1
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.079g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.236g/mol
Monoisotopic Mass:
213.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties