AG009588

104866-53-7 | 1,8-Naphthyridine-3-carboxylic acid

AG009588

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CAS Number	104866-53-7
Catalog Number	AG009588(AGN-PC-0LGG0X)
Chemical Name	1,8-Naphthyridine-3-carboxylic acid
IUPAC Name	1,8-naphthyridine-3-carboxylic acid
InChI	InChI=1S/C9H6N2O2/c12-9(13)7-4-6-2-1-3-10-8(6)11-5-7/h1-5H,(H,12,13)
InChI Key	CGXLVFZJJOXEDF-UHFFFAOYSA-N
MDL Number	MFCD06254513
Molecular Formula	C9H6N2O2
Molecular Weight	174.1561
SMILES	O=C(C1=CC2=CC=CN=C2N=C1)O
Synonyms	1,8-naphthyridine-3-carboxylic Acid, 104866-53-7, naphthyridine-3-carboxylic acid, AC1NHDH4, SCHEMBL124592, CTK8G4965, DTXSID60406206, CGXLVFZJJOXEDF-UHFFFAOYSA-N, ZINC8435708, FCH832466, MFCD06254513, STL253424, [1,8]naphthyridine-3-carboxylic acid, AKOS002665909, AB23694, DS-6073, MCULE-8932686243, AJ-57562, AK113006, AX8167752, pyridino[2,3-b]pyridine-3-carboxylic acid, ST45175006, 1,8-naphthyridine-3-carboxylicacid, CID4738391,

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

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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