AG00DCM7

4831-43-0 | 3,3-Dimethyl-2-pyrrolidinone

AG00DCM7

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CAS Number	4831-43-0
Catalog Number	AG00DCM7(AGN-PC-0LMVWX)
Chemical Name	3,3-Dimethyl-2-pyrrolidinone
IUPAC Name	3,3-dimethylpyrrolidin-2-one
InChI	InChI=1S/C6H11NO/c1-6(2)3-4-7-5(6)8/h3-4H2,1-2H3,(H,7,8)
InChI Key	IYZVTTRRGCJXGK-UHFFFAOYSA-N
MDL Number	MFCD16622813
Molecular Formula	C6H11NO
Molecular Weight	113.1576
SMILES	CC1(C)C(=O)NCC1
Synonyms	3,3-dimethylpyrrolidin-2-one, 4831-43-0, 3,3-dimethyl-2-pyrrolidinone, 2-Pyrrolidinone, 3,3-dimethyl-, MFCD16622813, 4-dimethyl-5-pyrrolidone, AC1NOL01, SCHEMBL247639, 3,3-Dimethyl-2-pyrrolizinone, CHEMBL294847, 3,3-Dimethyl-pyrrolidin-2-one, CTK1D1291, DTXSID40408485, IYZVTTRRGCJXGK-UHFFFAOYSA-N, 4182AE, ZINC13755860, AKOS006337074, FE-0712, MCULE-7206545498, RP09629, SB12003, KS-0000253B, AJ-64364, TR-036858, CS-0046646, FT-0681970, Y-7710, I11-807, J-511090, Z2255111560, C6H11NO, CID5114908, 3,3-dimethylpyrrolidin-2-one, 95% - 1G 1g,

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	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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

Lot Number