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89795-70-0 | 2-Aminopyridine-3,5-dicarboxylic acid
CAS No: 89795-70-0 Catalog No: AG003ZO6 MDL No:MFCD01318242
Product Description
Catalog Number:
AG003ZO6
Chemical Name:
2-Aminopyridine-3,5-dicarboxylic acid
CAS Number:
89795-70-0
Molecular Formula:
C7H6N2O4
Molecular Weight:
182.1335
MDL Number:
MFCD01318242
IUPAC Name:
2-aminopyridine-3,5-dicarboxylic acid
InChI:
InChI=1S/C7H6N2O4/c8-5-4(7(12)13)1-3(2-9-5)6(10)11/h1-2H,(H2,8,9)(H,10,11)(H,12,13)
InChI Key:
IVLPFCOWTKBYGG-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(c(c1)C(=O)O)N
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.033g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
182.135g/mol
Monoisotopic Mass:
182.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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