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197507-59-8 | 1,6-Naphthyridine-2-carboxylicacid
CAS No: 197507-59-8 Catalog No: AG002AV0 MDL No:MFCD00202908
Product Description
Catalog Number:
AG002AV0
Chemical Name:
1,6-Naphthyridine-2-carboxylicacid
CAS Number:
197507-59-8
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
MDL Number:
MFCD00202908
IUPAC Name:
1,6-naphthyridine-2-carboxylic acid
InChI:
InChI=1S/C9H6N2O2/c12-9(13)8-2-1-6-5-10-4-3-7(6)11-8/h1-5H,(H,12,13)
InChI Key:
OZZMWXQJCJUCEJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(n1)ccnc2
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.159g/mol
Monoisotopic Mass:
174.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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