argentio 2-{1-[2-(argentiooxy)-2-oxoethyl]cyclohexyl}acetate

• ChemBase ID: 79936
• Molecular Formular: C10H14Ag2O4
• Molecular Mass: 413.95216
• Monoisotopic Mass: 411.89940293
• SMILES: O=C(CC1(CC(=O)O[Ag])CCCCC1)O[Ag]
• Canonical SMILES: [Ag]OC(=O)CC1(CCCCC1)CC(=O)O[Ag]
• InChI: InChI=1S/C10H16O4.2Ag/c11-8(12)6-10(7-9(13)14)4-2-1-3-5-10;;/h1-7H2,(H,11,12)(H,13,14);;/q;2*+1/p-2
• InChIKey: BRUDDTQZICTLHD-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: argentio 2-{1-[2-(argentiooxy)-2-oxoethyl]cyclohexyl}acetate
• IUPAC Traditional name: argentio 2-{1-[2-(argentiooxy)-2-oxoethyl]cyclohexyl}acetate
• Synonyms: Bis-silvercyclohexyl-1,1-diacetate

Database IDs

• MDL Number: MFCD00218729
• PubChem SID: 162044699
• PubChem CID: 2775633

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 1.4513
• LogD (pH = 7.4): 1.4513
• Log P: 1.4513
• Molar Refractivity: 47.3073 cm^3
• Polarizability: 28.99594 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true