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1256793-40-4 | 2-Pyridinecarboxylic acid, 5-amino-6-methoxy-
CAS No: 1256793-40-4 Catalog No: AG000OD6 MDL No:
Product Description
Catalog Number:
AG000OD6
Chemical Name:
2-Pyridinecarboxylic acid, 5-amino-6-methoxy-
CAS Number:
1256793-40-4
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
IUPAC Name:
5-amino-6-methoxypyridine-2-carboxylic acid
InChI:
InChI=1S/C7H8N2O3/c1-12-6-4(8)2-3-5(9-6)7(10)11/h2-3H,8H2,1H3,(H,10,11)
InChI Key:
NKRHSORGLQIRFR-UHFFFAOYSA-N
SMILES:
COc1nc(ccc1N)C(=O)O
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.053g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.152g/mol
Monoisotopic Mass:
168.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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