AG002IWL

20721-18-0 | 2(1H)-Pyrazinone, 6-methyl-

AG002IWL

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CAS Number	20721-18-0
Catalog Number	AG002IWL(AGN-PC-0JP8DF)
Chemical Name	2(1H)-Pyrazinone, 6-methyl-
IUPAC Name	6-methyl-1H-pyrazin-2-one
InChI	InChI=1S/C5H6N2O/c1-4-2-6-3-5(8)7-4/h2-3H,1H3,(H,7,8)
InChI Key	KXUOIHWSSNTEPE-UHFFFAOYSA-N
MDL Number	MFCD08705761
Molecular Formula	C5H6N2O
Molecular Weight	110.1139
NSC Number	143141
SMILES	OC1=NC(C)=CN=C1
Synonyms	N-((R)-1-(2,4-dichlorophenyl)ethyl)-2-cyano-3,3-dimethylbutanamide, N-((S)-1-(2,4-dichlorophenyl)ethyl)-2-cyano-3,3-dimethylbutanamide, S-2900, S-2900S, 2-Hydroxy-6-methylpyrazine, 6-methylpyrazin-2-ol, 20721-18-0, 6-methyl-1H-pyrazin-2-one, 2(1H)-Pyrazinone, 6-methyl-, 6-Methylpyrazin-2-one, 6-methylpyrazin-2-ol 2-Hydroxy-6-methylpyrazine, NSC143141, AC1L63OF, AC1Q2RG9, 6-methylpyrazin-2(1H)-one, KSC491G2D, ACMC-20c453, SCHEMBL2629277, Jsp004243, CTK3J1321, DTXSID00301408, ANW-50658, CH-662, MFCD08705761, WT1952, ZINC16955338, AKOS006290027, AKOS025310541, ACN-050921, AM84719, CS-W003559, NSC-143141, RP00494, RTC-060122, TRA0096099, KS-0000099V, AJ-69801, AK-26663, AN-13078, AS-18750, BR-26663, CJ-15699, EN002252, QC-10334, SC-26638, SY004473, 20721-18-0 2-hydroxy-6-methylpyrazine, AB0029145, AB0072750, AB1000125, ST2412456, TC-060122, 4CH-000970, FT-0650121, X1277, S-2900, MFCD08705761 (97+%), 721H180, I13-0041, W-206548, null, C5H6N2O, 2(1H)-Pyrazinone,6-methyl-, AR-1H2333, CID285725, 20814-38-4,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	110.048g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	110.116g/mol
Monoisotopic Mass	110.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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