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885277-03-2

885277-03-2 | Methyl 6-(2-aminophenyl)nicotinate

CAS No: 885277-03-2 Catalog No: AG0047BB MDL No:MFCD06738706

Product Description

Catalog Number:
AG0047BB
Chemical Name:
Methyl 6-(2-aminophenyl)nicotinate
CAS Number:
885277-03-2
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
MDL Number:
MFCD06738706
IUPAC Name:
methyl 6-(2-aminophenyl)pyridine-3-carboxylate
InChI:
InChI=1S/C13H12N2O2/c1-17-13(16)9-6-7-12(15-8-9)10-4-2-3-5-11(10)14/h2-8H,14H2,1H3
InChI Key:
ALLZKESLYQKDHC-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nc1)c1ccccc1N

Properties

Complexity:
270  
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:
3  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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