AG003KFX

66899-02-3 | 4,4-Dimethylpyrrolidin-2-one

AG003KFX

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CAS Number	66899-02-3
Catalog Number	AG003KFX(AGN-PC-0JU649)
Chemical Name	4,4-Dimethylpyrrolidin-2-one
IUPAC Name	4,4-dimethylpyrrolidin-2-one
InChI	InChI=1S/C6H11NO/c1-6(2)3-5(8)7-4-6/h3-4H2,1-2H3,(H,7,8)
InChI Key	HGVPKAGCVCGRDQ-UHFFFAOYSA-N
MDL Number	MFCD09864496
Molecular Formula	C6H11NO
Molecular Weight	113.1576
SMILES	O=C1NCC(C)(C)C1
Synonyms	4,4-dimethylpyrrolidin-2-one, 4,4-Dimethyl-2-pyrrolidinone, 66899-02-3, 2-pyrrolidinone, 4,4-dimethyl-, MFCD09864496, 4,4-dimethylpyrrolidine-2-one, 2-PYRROLIDONE,4,4-DIMETHYL, AC1LCUJZ, 4,4-dimethyl-2-pyrrolidone, SCHEMBL248285, 4,4-dimethyl-pyrrolidin-2-one, 4, 4-Dimethyl-2-pyrrolidinone, CTK8E4651, DTXSID70348461, HGVPKAGCVCGRDQ-UHFFFAOYSA-N, ALBB-022301, CS-M3328, KS-00000E0M, 0268AC, ZINC14007343, AKOS005073486, MB-0820, MCULE-1184902754, RP09627, TRA0025797, AJ-64613, AK118621, BP-13301, SC-70558, SY015235, AB0063963, TR-022561, FT-0681222, A23044, C-4456, MFCD09864496 (95+%), I11-808, J-514027, InChI=1/C6H11NO/c1-6(2)3-5(8)7-4-6/h3-4H2,1-2H3,(H,7,8, C6H11NO, CID637593, 3-(hydroxymethyl)-4-methoxybenzaldehyde,

Complexity	118
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	113.084g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	113.16g/mol
Monoisotopic Mass	113.084g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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