AG001G2A

14121-55-2 | 6-Quinoxalinecarboxylic acid, 1,2,3,4-tetrahydro-2,3-dioxo-

AG001G2A

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CAS Number	14121-55-2
Catalog Number	AG001G2A(AGN-PC-0JLUYM)
Chemical Name	6-Quinoxalinecarboxylic acid, 1,2,3,4-tetrahydro-2,3-dioxo-
EC Number	237-975-9
IUPAC Name	2,3-dioxo-1,4-dihydroquinoxaline-6-carboxylic acid
InChI	InChI=1S/C9H6N2O4/c12-7-8(13)11-6-3-4(9(14)15)1-2-5(6)10-7/h1-3H,(H,10,12)(H,11,13)(H,14,15)
InChI Key	YGJDUUUPLPMKSN-UHFFFAOYSA-N
MDL Number	MFCD00907425
Molecular Formula	C9H6N2O4
Molecular Weight	206.1549
NSC Number	211121
SMILES	O=C(C1=CC2=C(NC(C(N2)=O)=O)C=C1)O
Synonyms	14121-55-2, 2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid, 1,2,3,4-Tetrahydro-2,3-dioxoquinoxaline-6-carboxylic acid, 2,3-dihydroxyquinoxaline-6-carboxylic acid, 2,3-dioxo-1,4-dihydroquinoxaline-6-carboxylic acid, 2,3-Dioxo-1,2,3,4-tetrahydro-quinoxaline-6-carboxylic acid, EINECS 237-975-9, NSC211121, 6-quinoxalinecarboxylic acid,2,3-dihydroxy-, AC1Q5U2C, Cambridge id 6121956, TimTec1_003880, TimTec1_006921, Oprea1_006451, Oprea1_330490, SCHEMBL939954, AC1L370A, AC1Q73I7, CHEMBL119727, CTK0H9892, CTK7I8509, DTXSID80161603, YGJDUUUPLPMKSN-UHFFFAOYSA-N, HMS1545A08, HMS1553K13, ALBB-030900, ZINC9439636, BBL028241, BBL036420, MFCD00907425, SBB027690, STK069360, STL490544, AKOS000112723, AKOS000117140, MCULE-8238281319, NSC-211121, AJ-70956, BAS 08314880, ST056123, EN300-07268, Y-8207, AB00980292-01, W-110367, BRD-K41613021-001-03-5, Z56968762, 2,3-dihydroxyquinoxaline-6-carboxylic acid, AldrichCPR, F0919-3863, 1,2,3,4-tetrahydro-2,3-dioxoquinoxaline-6-carboxylicacid, 6-Quinoxalinecarboxylicacid, 1,2,3,4-tetrahydro-2,3-dioxo-, 2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid, AldrichCPR, C9-H6-N2-O4, CID84211, AR-1H2578, 6-Quinoxalinecarboxylic acid, 1,2,3,4-tetrahydro-2,3-dioxo-, 142860-99-9,

Complexity	328
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.033g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	206.157g/mol
Monoisotopic Mass	206.033g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	95.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code

Certificate of Analysis

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