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1314979-29-7 | 1,6-Naphthyridine-2-carboxylic acid, 7-amino-
CAS No: 1314979-29-7 Catalog No: AG000WCD MDL No:MFCD08062620
Product Description
Catalog Number:
AG000WCD
Chemical Name:
1,6-Naphthyridine-2-carboxylic acid, 7-amino-
CAS Number:
1314979-29-7
Molecular Formula:
C9H7N3O2
Molecular Weight:
189.1708
MDL Number:
MFCD08062620
IUPAC Name:
7-amino-1,6-naphthyridine-2-carboxylic acid
InChI:
InChI=1S/C9H7N3O2/c10-8-3-7-5(4-11-8)1-2-6(12-7)9(13)14/h1-4H,(H2,10,11)(H,13,14)
InChI Key:
NHCQRIUKQVWSRQ-UHFFFAOYSA-N
SMILES:
Nc1ncc2c(c1)nc(cc2)C(=O)O
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.054g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.174g/mol
Monoisotopic Mass:
189.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
89.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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