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1,5-naphthyridine-4-carboxylic acid

1,5-naphthyridine-4-carboxylic acid

CAS: 79426-14-5

Formula: C9H6N2O2

SMILES: OC(=O)C1=CC=NC2=CC=CN=C12

IUPAC: 1,5-naphthyridine-4-carboxylic acid

InChI: InChI=1S/C9H6N2O2/c12-9(13)6-3-5-10-7-2-1-4-11-8(6)7/h1-5H,(H,12,13)

Composition: C (62.07%), H (3.47%), N (16.09%), O (18.37%)

Molar Mass: 174.159

Atom Count: 19

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 174.042927441
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey HQMKWWYYKCFZJF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.71
Topological Polar Surface Area 63.08
Polarizability 18.38
Ring Count 2
Rotatable Bond Count 1

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