AG003U20

59648-14-5 | Pyridazine-4,5-dicarboxylic Acid

AG003U20

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CAS Number	59648-14-5
Catalog Number	AG003U20(AGN-PC-0LT8SE)
Chemical Name	Pyridazine-4,5-dicarboxylic Acid
IUPAC Name	pyridazine-4,5-dicarboxylic acid
InChI	InChI=1S/C6H4N2O4/c9-5(10)3-1-7-8-2-4(3)6(11)12/h1-2H,(H,9,10)(H,11,12)
InChI Key	YRTBTTMXMPXJBB-UHFFFAOYSA-N
MDL Number	MFCD06742784
Molecular Formula	C6H4N2O4
Molecular Weight	168.1070
SMILES	OC(=O)C1=CN=NC=C1C(O)=O
Synonyms	Pyridazine-4,5-dicarboxylic Acid, 59648-14-5, 4,5-Pyridazinedicarboxylic acid, 4,5-Dicarboxypyridazine, 4,5-Pyridazinedicarboxylicacid, PYRIDAZINE-4,5-DICARBOXYLICACID, AC1O4UYF, SCHEMBL70537, pyridazine-4,5-carboxylic acid, CTK1G9547, DTXSID10423509, YRTBTTMXMPXJBB-UHFFFAOYSA-N, BCP19514, KS-00000CH3, ZINC1529132, ANW-47150, CP-321, KM0331, MFCD06742784, SBB088134, AKOS000320055, CS-W020555, PS-8731, RP02550, TRA0050826, AJ-26568, AK-59858, AN-39581, SC-26909, SY005769, AB1000571, DB-030306, TR-020671, 4CH-021775, FT-0677435, ST24049065, W7246, MFCD06742784 (97+%), 648P145, A832398, A1-00166, I04-1545, J-524087, Z1741962293, null, C6H4N2O4, CID6417081,

Complexity	184
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.017g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	168.108g/mol
Monoisotopic Mass	168.017g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	100A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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