AG0037IW

39799-77-4 | 1-Methyl-1,3-dihydro-imidazol-2-one

AG0037IW

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CAS Number	39799-77-4
Catalog Number	AG0037IW(AGN-PC-0JT02V)
Chemical Name	1-Methyl-1,3-dihydro-imidazol-2-one
IUPAC Name	3-methyl-1H-imidazol-2-one
InChI	InChI=1S/C4H6N2O/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)
InChI Key	PXHFWPOPKVWXQT-UHFFFAOYSA-N
MDL Number	MFCD11520048
Molecular Formula	C4H6N2O
Molecular Weight	98.1032
SMILES	Cn1cc[nH]c1=O
Synonyms	39799-77-4, 1-Methyl-1,3-dihydro-imidazol-2-one, 1-methyl-1h-imidazol-2(3h)-one, 1-methyl-2,3-dihydro-1H-imidazol-2-one, 3-methyl-1H-imidazol-2-one, 1-methyl-4-imidazolin-2-one, PXHFWPOPKVWXQT-UHFFFAOYSA-N, 1-Methyl-1,3-dihydro-2H-imidazol-2-one, 2,3-2H-4-Methyl-imidazole-2-one, AC1LBYPG, 3-methylimidazol-2-one, 1,3-dihydro-1-methyl-2H-Imidazol-2-one, 2-hydroxy-1-methylimidazole, 1-methyl-1h-imidazol-2-ol, CHEMBL157963, CTK4I1911, CTK6I3326, KS-00000SQS, DTXSID90340689, 1-methyl-2(1H,3H)-imidazolone, 1-Methyl-1H-imidazole-2(3H)-one, MFCD11520048, ZINC27657031, AKOS006324722, MCULE-9198950029, DA-06189, FT-0723363, 1-Methyl-1,3-dihydro-2H-imidazol-2-one #, A-6830, Z1549446296, CID566589, 1416373-67-5,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	98.048g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	98.105g/mol
Monoisotopic Mass	98.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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