Home Aminos Benzyl 6-aminonicotinate

Benzyl 6-aminonicotinate

CAS No.:
935687-49-3
Catalog Number:
AG003O3U
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
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Product Description
Catalog Number:
AG003O3U
Chemical Name:
Benzyl 6-aminonicotinate
CAS Number:
935687-49-3
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
MDL Number:
MFCD12913991
IUPAC Name:
benzyl 6-aminopyridine-3-carboxylate
InChI:
InChI=1S/C13H12N2O2/c14-12-7-6-11(8-15-12)13(16)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,14,15)
InChI Key:
WZFRFMFRNZBTPU-UHFFFAOYSA-N
SMILES:
Nc1ccc(cn1)C(=O)OCc1ccccc1
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.09g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.251g/mol
Monoisotopic Mass:
228.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties