AG00CIUP

3260-44-4 | 4-Hydroxyphthalazine-1-carboxylicacid

AG00CIUP

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CAS Number	3260-44-4
Catalog Number	AG00CIUP(AGN-PC-0O8XO0)
Chemical Name	4-Hydroxyphthalazine-1-carboxylicacid
IUPAC Name	4-oxo-3H-phthalazine-1-carboxylic acid
InChI	InChI=1S/C9H6N2O3/c12-8-6-4-2-1-3-5(6)7(9(13)14)10-11-8/h1-4H,(H,11,12)(H,13,14)
InChI Key	YHNOBCUFJJRVOP-UHFFFAOYSA-N
MDL Number	MFCD00524727
Molecular Formula	C9H6N2O3
Molecular Weight	190.1555
SMILES	OC(=O)C1=NNC(=O)C2=CC=CC=C12
Synonyms	3260-44-4, 4-oxo-3,4-dihydrophthalazine-1-carboxylic acid, 4-Oxo-3,4-dihydro-phthalazine-1-carboxylic acid, 4-Hydroxyphthalazine-1-carboxylicacid, 4-oxo-3H-phthalazine-1-carboxylic acid, 4-hydroxyphthalazine-1-carboxylic acid, YHNOBCUFJJRVOP-UHFFFAOYSA-N, 4-oxo-3,4-dihydro-1-phthalazinecarboxylic acid, 1-Phthalazinecarboxylic acid, 3,4-dihydro-4-oxo-, 4-carboxy-1(2H)-phthalazinone, 4-oxo-3-hydrophthalazinecarboxylic acid, ZERO/005812, AC1LFENU, ChemDiv1_008701, AC1Q5T1M, Oprea1_028704, CHEMBL20087, SCHEMBL2446205, SCHEMBL10357263, CTK1C5994, HMS611L11, DTXSID10354602, ZINC266969, AC1Q7484, ALBB-010222, ANW-71485, BBL007917, BBL018372, HTS028116, MFCD00524727, RW3997, SBB010819, STK727081, 4(3h)-phthalazone-1-carboxylic acid, AKOS000114873, AKOS000320431, CCG-202973, MCULE-6257263141, phthalazin-1(2h)-one-4-carboxylic acid, AJ-18631, AK-81389, BAS 02824402, NS-01753, phthalazin-1 (2h)-one-4-carboxylic acid, AB0153190, AB1008867, ST4127341, BB 0241864, EU-0066644, FT-0677071, EN300-00787, W-7858, 1-Phthalazinecarboxylicacid, 3,4-dihydro-4-oxo-, AE-641/05572025, SR-01000474810, I04-5673, J-018801, SR-01000474810-1, Z56791146, F0896-0358, 1-Phthalazinone-4-carboxylicacid; 3,4-Dihydro-4-oxo-1-phthalazinecarboxylic acid, N-(4-methoxybenzyl)-1-(2-methylbenzyl)-1H-1,2,3-benzotriazole-5-carboxamide, C9H6N2O3, AR-1G2875, CID776855, 32806-62-5,

Complexity	311
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.038g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	190.158g/mol
Monoisotopic Mass	190.038g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	78.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

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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