AG008NZM

7712-28-9 | 2-Quinoxalinepropanoicacid, 3,4-dihydro-3-oxo-

AG008NZM

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CAS Number	7712-28-9
Catalog Number	AG008NZM(AGN-PC-0JPIDF)
Chemical Name	2-Quinoxalinepropanoicacid, 3,4-dihydro-3-oxo-
IUPAC Name	3-(3-oxo-4H-quinoxalin-2-yl)propanoic acid
InChI	InChI=1S/C11H10N2O3/c14-10(15)6-5-9-11(16)13-8-4-2-1-3-7(8)12-9/h1-4H,5-6H2,(H,13,16)(H,14,15)
InChI Key	HROJWOXFEZYMGL-UHFFFAOYSA-N
MDL Number	MFCD01820403
Molecular Formula	C11H10N2O3
Molecular Weight	218.2087
SMILES	O=C(O)CCC1=NC2=CC=CC=C2N=C1O
Synonyms	3-(2'-hydroxycarbonylethyl)-2-quinoxalinol, 3-hydroxy-2-quinoxalinepropionic acid, quinoxalinol-ketoglutarate, 7712-28-9, 3-(3-Oxo-3,4-dihydro-quinoxalin-2-yl)-propionic acid, 3-(3-hydroxyquinoxalin-2-yl)propanoic acid, 3-(3-oxo-3,4-dihydroquinoxalin-2-yl)propanoic acid, 3-Hydroxy-2-quinoxalinepropionic acid, HROJWOXFEZYMGL-UHFFFAOYSA-N, 2-Quinoxalinepropanoicacid, 3,4-dihydro-3-oxo-, 3-(2-carboxyethyl)-2(1h)-quinoxalinone, 3-(3-oxo-4H-quinoxalin-2-yl)propanoic acid, 3-(3-Oxo-3,4-dihydro-2-quinoxalinyl)propanoic acid, Quinoxalinol-ketoglutarate, 3-(2'-Hydroxycarbonylethyl)-2-quinoxalinol, ACMC-1BH7D, ChemDiv1_003696, AC1Q75AL, AC1Q75AZ, Cambridge id 5913107, Cambridge id 6370605, TimTec1_002177, Oprea1_536901, Oprea1_782335, AC1L46F3, SCHEMBL1128908, CTK2H9690, HMS597H22, DTXSID70227909, HMS1540C21, ALBB-005213, ZINC8861082, 3-Carboxyethyl-2(1H) quinoxalinone, ANW-36953, BBL005594, MFCD00843539, SBB007278, STK388247, STK499953, AKOS000267426, AKOS002348554, CCG-106767, MCULE-4630620270, SDCCGMLS-0065507.P001, AJ-70131, BAS 01157172, ST028992, AB0167289, 3-(3-Hydroxy-2-quinoxalinyl)propanoic acid, 3-(3-hydroxyquinoxaline-2-yl)propanoic acid, EN300-04352, 3,4-Dihydro-3-oxo-2-quinoxalinepropanoic acid, L-5282, W-7672, 3-(3-oxo-4-hydroquinoxalin-2-yl)propanoic acid, AB00685400-01, 2-Quinoxalinepropanoic acid, 3,4-dihydro-3-oxo-, SR-01000435046, SR-01000439234, SR-01000435046-1, SR-01000439234-1, 3-(3-oxo-3,4-dihydro-quinoxalin-2-yl)propanoic acid, Z56862720, 3-(3-Hydroxy-2-quinoxalinyl)propanoic acid AldrichCPR, 3-(3-Hydroxy-2-quinoxalinyl)propanoic acid, AldrichCPR, 3-(3-Oxo-3,4-dihydro-2-quinoxalinyl)propanoic acid #, F0907-7709, A2094/0088002, 3- -PROPIONICACID, CID151480, C11-H10-N2-O3,

Complexity	338
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.069g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	218.212g/mol
Monoisotopic Mass	218.069g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	78.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

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

Lot Number