AC1MIK0L

6-[[2-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-4-yl]oxycarbonyl]cyclohex-3-ene-1-carboxylic acid

Also Known As: 4-Cyclohexene-1,2-dicarboxylic acid, mono(2-(2-(1-methylethoxy)-1-((1-methylethoxy)carbonyl)-2-oxoethylidene)-1,3-dithiolan-4-yl) ester|6-[[2-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-4-yl]oxycarbonyl]cyclohex-3-ene-1-carboxylic acid|6-{[(2-{1,3-Dioxo-1,3-bis[(propan-2-yl)oxy]propan-2-ylidene}-1,3-dithiolan-4-yl)oxy]carbonyl}cyclohex-3-ene-1-carboxylic acid

Molecular Formula	C20H26O8S2
Molecular Weight	458.1069 g/mol
LogP	3.1175
Topological Polar Surface Area	116.2 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	7
Exact Mass	458.1069
Monoisotopic Mass	458.1069
Heavy Atoms	30
Complexity	731.90546

Chemical Identifiers

CAS Number	62052-65-7
SMILES	CC(C)OC(=O)C(=C1SCC(S1)OC(=O)C2CC=CCC2C(=O)O)C(=O)OC(C)C