Home Aminos 3-((5-methylpyridin-2-yl)amino)benzoic acid

3-((5-methylpyridin-2-yl)amino)benzoic acid

CAS No.:
1099057-20-1
Catalog Number:
AG01BRKU
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
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Product Description
Catalog Number:
AG01BRKU
Chemical Name:
3-((5-methylpyridin-2-yl)amino)benzoic acid
CAS Number:
1099057-20-1
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
MDL Number:
MFCD14699343
IUPAC Name:
3-[(5-methylpyridin-2-yl)amino]benzoic acid
InChI:
InChI=1S/C13H12N2O2/c1-9-5-6-12(14-8-9)15-11-4-2-3-10(7-11)13(16)17/h2-8H,1H3,(H,14,15)(H,16,17)
InChI Key:
SDJXUYBWAFPJMH-UHFFFAOYSA-N
SMILES:
Cc1ccc(nc1)Nc1cccc(c1)C(=O)O
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:
2  
Isotope Atom Count:
0
Molecular Weight:
228.251g/mol
Monoisotopic Mass:
228.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties