3,4-Dimethyl-1,2-cyclopentanedione

CAS	13494-06-9
Structure
IUPAC Name	3,4-Dimethylcyclopentane-1,2-dione
Molecular Weight	126.15
Canonical SMILES	CC1CC(=O)C(=O)C1C
InChI	InChI=1S/C7H10O2/c1-4-3-6(8)7(9)5(4)2/h4-5H,3H2,1-2H3
InChI Key	WGAVDEVFJDQIMZ-UHFFFAOYSA-N
Boiling Point	194.28 °C
Melting Point	68-72 °C
Purity	98%+
Density	1.0579 g/mL at 25 °C(lit.)
Solubility	Slightly soluble in water
Exact Mass	126.068079557
Monoisotopic Mass	126.068079557
Physical State	Crystalline powder
Refractive Index	n20/D 1.4690(lit.)
Storage Conditions	Inert atmosphere,2-8 °C
Topological Polar Surface Area	34.1 Ų