AG007I9A

3123-97-5 | 5,5-Dimethyldihydrofuran-2(3H)-one

AG007I9A

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CAS Number	3123-97-5
Catalog Number	AG007I9A(AGN-PC-0JKE22)
Chemical Name	5,5-Dimethyldihydrofuran-2(3H)-one
IUPAC Name	5,5-dimethyloxolan-2-one
InChI	InChI=1S/C6H10O2/c1-6(2)4-3-5(7)8-6/h3-4H2,1-2H3
InChI Key	NPHAVLULUWJQAS-UHFFFAOYSA-N
MDL Number	MFCD08061147
Molecular Formula	C6H10O2
Molecular Weight	114.1424
SMILES	CC1(C)OC(=O)CC1
UNII	MN93807ZPO
Synonyms	3123-97-5, 5,5-dimethyldihydrofuran-2(3h)-one, 5,5-Dimethyl-dihydro-furan-2-one, Iso-caprolactone, 5,5-dimethyloxolan-2-one, Isocaprolactone, 4-Methylpentan-4-olide, UNII-MN93807ZPO, 2(3H)-Furanone, dihydro-5,5-dimethyl-, .gamma.-Isocaprolactone, 4-Methyl-4-pentanolide, 4,4-dimethyl-butyrolactone, 4-Methyl-4-hydroxypentanoic acid lactone, MN93807ZPO, NPHAVLULUWJQAS-UHFFFAOYSA-N, 5,5-dimethyltetrahydrofuran-2-one, Dimethylbutyrolactone, Tetrahydro-5,5-dimethyl-2-furanone, .gamma.-Methyl-.gamma.-valerolactone, .gamma.,.gamma.-Dimethylbutyrolactone, DIHYDRO-5,5-DIMETHYL-2(3H)-FURANONE, .gamma.,.gamma.-Dimethyl-.gamma.-butyrolactone, NSC128078, AC1L2BYO, AC1Q2CNG, 4,4-dimethylbutan-4-olide, SCHEMBL92282, Dimethylbutyrolactone (Related), 5,5-dimethyldihydrofuran-2-one, CTK4G6613, KS-00000KIG, DTXSID10185150, 4,4-dimethyl-gamma-butyro lactone, 4,4-Dimethyl-dihydro-furan-2-one, ZINC5082834, MFCD08061147, NSC221122, 5,5-Dimethyldihydro-2(3H)-furanone, AKOS004120865, AN-2556, MCULE-3069658569, NSC-128078, NSC-221122, 2(3H)-Furanone,dihydro-5,5-dimethyl-, 5,5-Dimethyldihydro-2(3H)-furanone #, AJ-53080, AK-44637, DS-13384, SC-21203, AB0073121, DB-014394, TX-012095, A5658, CS-0061120, FT-0647959, EN300-56400, 5,5-dimethyl-dihydro-furan-2-one, AldrichCPR, A-1781, Pentanoic acid 4-hydroxy 4-methyl-.gamma.-lactone, J-018287, S14-2568, Z1197990700, InChI=1/C6H10O2/c1-6(2)4-3-5(7)8-6/h3-4H2,1-2H, 4,4-Dimethylbutyrolactone, 2(3H)-Furanone,5-dimethyl-, CID18398,

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	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number