1-Cyclobutylbutane-1,3-dione

Catalog Number	ACM1020732200-1
CAS	1020732-20-0
Structure
Synonyms	1,3-Butanedione, 1-cyclobutyl-
IUPAC Name	1-cyclobutylbutane-1,3-dione
Molecular Weight	140.18
Molecular Formula	C8H12O2
Canonical SMILES	CC(=O)CC(=O)C1CCC1
InChI	HKRKQPSKAPDZLT-UHFFFAOYSA-N
InChI Key	InChI=1S/C8H12O2/c1-6(9)5-8(10)7-3-2-4-7/h7H,2-5H2,1H3
Boiling Point	220.0±13.0 °C(Predicted)
Purity	98%
Density	1.059±0.06 g/cm3(Predicted)
Appearance	Solid
Exact Mass	140.08400
Isomeric SMILES	CC(=O)CC(=O)C1CCC1