AG003GBK

25594-62-1 | 2-Acetylquinoxaline

AG003GBK

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CAS Number	25594-62-1
Catalog Number	AG003GBK(AGN-PC-0NFZ9A)
Chemical Name	2-Acetylquinoxaline
IUPAC Name	1-quinoxalin-2-ylethanone
InChI	InChI=1S/C10H8N2O/c1-7(13)10-6-11-8-4-2-3-5-9(8)12-10/h2-6H,1H3
InChI Key	SWGILLQQUULMJB-UHFFFAOYSA-N
MDL Number	MFCD07808559
Molecular Formula	C10H8N2O
Molecular Weight	172.1833
SMILES	CC(C1=NC2=CC=CC=C2N=C1)=O
Synonyms	2-Acetylquinoxaline, 25594-62-1, 1-(Quinoxalin-2-yl)ethanone, Ethanone, 1-(2-quinoxalinyl)-, 1-quinoxalin-2-ylethanone, MFCD07808559, ACMC-1CKNL, SCHEMBL4642665, 2-acetylquinoxaline, AldrichCPR, CTK0J3913, DTXSID90455348, 1-(quinoxalin-2-yl)ethan-1-one, KS-00000C0Q, 5407AJ, ZINC12359267, AKOS015897251, AC-7254, AN-9203, MCULE-8957795247, TRA0035052, AJ-61437, AS-31241, CJ-13882, SC-27148, SY005383, AB0052768, TC-170988, ST50827394, K-6694, MFCD07808559 (97+%), I08-0473, C10H8N2O, CID11105814,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.064g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	172.187g/mol
Monoisotopic Mass	172.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	42.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number