AG002BH2

19838-07-4 | 2(1H)-Pyrazinone, 3-methyl-

AG002BH2

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CAS Number	19838-07-4
Catalog Number	AG002BH2(AGN-PC-0JLXBM)
Chemical Name	2(1H)-Pyrazinone, 3-methyl-
EC Number	243-362-7
IUPAC Name	3-methyl-1H-pyrazin-2-one
InChI	InChI=1S/C5H6N2O/c1-4-5(8)7-3-2-6-4/h2-3H,1H3,(H,7,8)
InChI Key	LDQRWMQHTORUIY-UHFFFAOYSA-N
MDL Number	MFCD01646120
Molecular Formula	C5H6N2O
Molecular Weight	110.1139
SMILES	O=C1C(C)=NC=CN1
UNII	S951QMJ75E
Synonyms	2-Hydroxy-3-methylpyrazine, 19838-07-4, 3-methylpyrazin-2-ol, 3-Methylpyrazin-2(1H)-one, 3-Methyl-2-pyrazinol, 3-methyl-1H-pyrazin-2-one, UNII-S951QMJ75E, 3-METHYL-2(1H)-PYRAZINONE, 2(1H)-PYRAZINONE, 3-METHYL-, S951QMJ75E, MFCD01646120, EINECS 243-362-7, AC1L3FDT, AC1Q2G7V, AC1Q69BC, SCHEMBL723777, 3-methylpyrazin-2 (1H)-one, 2(1H)-Pyrazinone,3-methyl-, CTK4E2502, LDQRWMQHTORUIY-UHFFFAOYSA-, DTXSID10173577, LDQRWMQHTORUIY-UHFFFAOYSA-N, 3-METHYL-2-HYDROXYPYRAZINE, 3-methyl-1,2-dihydropyrazin-2-one, ANW-56616, RW3391, ZINC14491607, AKOS005259132, AKOS022171438, CM-1666, CS-W016627, GS-5793, MCULE-9717185036, PB12942, QC-2738, RP18963, TRA0074105, KS-0000099L, AJ-64903, AK-24748, AN-16464, CJ-14548, SC-28350, SY005478, AB0032365, AB1000492, DB-006140, ST2417810, TC-020244, 4CH-015194, AM20070321, FT-0084746, FT-0600184, X5663, A20732, Q-1304, MFCD01646120 (97+%), 838H074, AC-907/34116029, Q-103310, S14-1861, F8881-3157, Z1741980425, InChI=1/C5H6N2O/c1-4-5(8)7-3-2-6-4/h2-3H,1H3,(H,7,8), C5H6N2O, 3-Methyl-(1H)-pyrazin-2-one, C5-H6-N2-O, CID88276, AR-1F4572, ACN-051493, C3247, H1519, 2-Hydroxy-3-methylpyrazine, 98% - 1G 1g, 1-(BROMOMETHYL)-2-FLUORO-4-NITROBENZENE, 20295-60-7, 26740-71-6,

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	-0.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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