AG0039PO

473932-16-0 | 6-Quinoxalineacetic acid

AG0039PO

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CAS Number	473932-16-0
Catalog Number	AG0039PO(AGN-PC-0WAEZL)
Chemical Name	6-Quinoxalineacetic acid
IUPAC Name	2-quinoxalin-6-ylacetic acid
InChI	InChI=1S/C10H8N2O2/c13-10(14)6-7-1-2-8-9(5-7)12-4-3-11-8/h1-5H,6H2,(H,13,14)
InChI Key	NRRFVLPMUSJDJY-UHFFFAOYSA-N
MDL Number	MFCD09880609
Molecular Formula	C10H8N2O2
Molecular Weight	188.1827
SMILES	N1=CC=NC2=CC(=CC=C12)CC(=O)O
Synonyms	2-(Quinoxalin-6-yl)acetic acid, 473932-16-0, Quinoxaline-6-acetic acid, (Quinoxalin-6-yl)acetic acid, 6-Quinoxalineacetic acid, quinoxalin-6-ylacetic acid, quinoxalin-6-yl-acetic acid, 6-(Carboxymethyl)quinoxaline, 2-quinoxalin-6-ylacetic acid, SCHEMBL2496318, CTK7J2365, DTXSID20593767, NRRFVLPMUSJDJY-UHFFFAOYSA-N, KS-00002A2T, ZX-AT003004, CQ-050, FCH836742, MFCD09880609, ZINC11567757, AKOS006282570, OR17707, PS-3976, RP03577, AJ-59816, AK136051, AX8167965, DB-070800, TR-039119, 4CH-002321, FT-0685160, ST24039766, Y5443, C-2089, J-506602, C10H8N2O2, 2-(quinoxalin-6-yl)acetic acid, 95% - 1G 1g,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.059g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	188.186g/mol
Monoisotopic Mass	188.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.1A^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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