AG000QON

126-81-8 | 1,3-Cyclohexanedione, 5,5-dimethyl-

AG000QON

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CAS Number	126-81-8
Catalog Number	AG000QON(AGN-PC-0JKLVE)
Chemical Name	1,3-Cyclohexanedione, 5,5-dimethyl-
EC Number	204-804-4
IUPAC Name	5,5-dimethylcyclohexane-1,3-dione
InChI	InChI=1S/C8H12O2/c1-8(2)4-6(9)3-7(10)5-8/h3-5H2,1-2H3
InChI Key	BADXJIPKFRBFOT-UHFFFAOYSA-N
MDL Number	MFCD00001588
Molecular Formula	C8H12O2
Molecular Weight	140.1797
SMILES	O=C1CC(CC(C)(C)C1)=O
UNII	B2B5DSX2FC
Synonyms	5,5-dimethylcyclohexane-1,3-dione, Dimedone, 126-81-8, 5,5-DIMETHYL-1,3-CYCLOHEXANEDIONE, 5,5-Dimethylcyclohexane-1,3-dione, Cyclomethone, Methone, Medon, Dimedon, Methon, 1,3-Cyclohexanedione, 5,5-dimethyl-, 5,5-Dimethyldihydroresorcinol, 5,5-Dimethylhydroresorcinol, 1,1-Dimethyl-3,5-diketocyclohexane, LU 274, Dimethyldihydroresorcinol, UNII-B2B5DSX2FC, 1,1-Dimethyl-3,5-cyclohexanedione, 5,5-dimethyl-cyclohexane-1,3-dione, NSC 14984, EINECS 204-804-4, MFCD00001588, B2B5DSX2FC, AI3-19939, BADXJIPKFRBFOT-UHFFFAOYSA-N, 5,5-dimethyl-1,3-cyclohexandione, 5,5'-dimethylcyclohexane-1,3-dione, 1,5-cyclohexanedione, 5,3-cyclohexanedione, 5,3-dione, 1,5-diketocyclohexane, 1, 5,5-dimethyl-, 5,5-Dimethyl-1,3-cyclohexanedione, 99%, Dimedone; Methone, AC1Q6EBH, EC 204-804-4, AC1L1LH2, KSC496G4H, SCHEMBL123127, Jsp001699, DTXSID8021987, CTK3J6343, 5,5-Dimethyl-1,3-cyclohexadione, 5,5-dimethyl-1,3-cyclohexandion, 5,5-dimethyl-1,3cyclohexanedione, 5,5-dimethylcyclohexan-1,3-dione, NSC14984, NSC17544, NSC43759, 5,5-Dimethyl-1,3-dihydroresorcinol, ANW-43461, BBL000648, NSC-14984, NSC-17544, NSC-43759, NSC242994, SBB058731, STK365156, 5, 5-dimethyl-1,3-cyclohexanedione, 5,5-dimethyl-1, 3-cyclohexanedione, AKOS000119900, ZINC100008249, CS-W016456, MCULE-7089250511, NSC-242994, RP20620, RTR-003892, SB15818, TRA0047870, KS-00000C20, AK-33057, AN-22982, AS-14592, BP-12997, L785, LS-56809, SC-17394, SY010547, 5,5-Dimethyl-1,3-cyclohexanedione, 95%, AB1003074, DB-041841, TR-003892, D0701, FT-0625018, ST24029222, ST50308237, MFCD00001588 (98%), A-8135, 138936-EP2272849A1, 138936-EP2292586A2, I14-1511, Q-200991, I14-21021, F0001-0386, Z1250100714, InChI=1/C8H12O2/c1-8(2)4-6(9)3-7(10)5-8/h3-5H2,1-2H, 5,5-Dimethyl-1,3-cyclohexanedione, for HPLC derivatization, for the determination of aldehyde formaldehyde, >=99.0%, Dimecrotic acid, C8H12O2, Dimedone 99.5% AR 25gm, CID31358, C8-H12-O2, Dimedone, 98% - 100G 100g, 206658-89-1, 3471-13-4,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.084g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	140.182g/mol
Monoisotopic Mass	140.084g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	34.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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