AG003NRP

3709-08-8 | 3,3-Dimethyldihydrofuran-2(3H)-One

AG003NRP

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CAS Number	3709-08-8
Catalog Number	AG003NRP(AGN-PC-0JM0UN)
Chemical Name	3,3-Dimethyldihydrofuran-2(3H)-One
IUPAC Name	3,3-dimethyloxolan-2-one
InChI	InChI=1S/C6H10O2/c1-6(2)3-4-8-5(6)7/h3-4H2,1-2H3
InChI Key	UPVAIJPDWVTFKT-UHFFFAOYSA-N
MDL Number	MFCD03844788
Molecular Formula	C6H10O2
Molecular Weight	114.1424
NSC Number	1094
SMILES	CC1(C(=O)OCC1)C
Synonyms	2,2-dimethyl-4-butyrolactone, alpha, alpha-dimethyl-gamma-butyrolactone, alpha-DMGBL, alpha,alpha-Dimethyl-gamma-butyrolactone, 3709-08-8, 3,3-dimethyldihydrofuran-2(3h)-one, 3,3-dimethyloxolan-2-one, 2(3H)-Furanone, dihydro-3,3-dimethyl-, Dihydro-3,3-dimethyl-2(3H)-furanone, 2,2-Dimethyl-4-butyrolactone, UPVAIJPDWVTFKT-UHFFFAOYSA-N, Butyric acid, 2,2-dimethyl-4-hydroxy-, g-lactone, Dimethylbutanolid, alpha-DMgBL, NSC1094, AC1L3STF, AC1Q6HQD, 2,2-dimethylbutyrolactone, Furanone, dihydrodimethyl-, a,a-Dimethyl-?-butyrolactone, CHEMBL33962, SCHEMBL149596, CTK2A6366, DTXSID30190584, 2(3H)-Furanone, dihydrodimethyl-, NSC 1094, NSC-1094, ZINC4353146, MFCD03844788, 3,3-Dimethyldihydro-2(3H)-furanone, AKOS015842168, 3,3-dimethyl-dihydrofuran-2(3H)-one, 3,3-dimethyldihydrofuran-2(3 H)-one, MCULE-4294599964, NE34631, RP19135, 4-HYDROXY-2, .GAMMA.-LACTONE, 2(3H)-Furanone,dihydro-3,3-dimethyl-, 3,3-Dimethyldihydro-2(3H)-furanone #, alpha,alpha-Dimethyl-gamma-butyrolactrone, AJ-50843, AS-30267, SC-15803, SY029932, D2733, FT-0082483, FT-0649075, MFCD03844788 (97%), I14-55811, Z1416282802, 64291-81-2, D09CKP, 3,3-Dimethyl-dihydro-furan-2-one, CID94746, AR-1E8743, 3967-01-9,

Complexity	116
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	114.068g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	114.144g/mol
Monoisotopic Mass	114.068g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H227-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

Lot Number