6,6,8,8-tetramethyl-7-oxa-1,3-diazaspiro[4.4]nonane-2,4-dione

• ChemBase ID: 240309
• Molecular Formular: C10H16N2O3
• Molecular Mass: 212.24564
• Monoisotopic Mass: 212.11609238
• SMILES: C12(C(=O)NC(=O)N1)C(OC(C2)(C)C)(C)C
• Canonical SMILES: O=C1NC(=O)NC21CC(OC2(C)C)(C)C
• InChI: InChI=1S/C10H16N2O3/c1-8(2)5-10(9(3,4)15-8)6(13)11-7(14)12-10/h5H2,1-4H3,(H2,11,12,13,14)
• InChIKey: KDELSQQYRLVNLG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6,6,8,8-tetramethyl-7-oxa-1,3-diazaspiro[4.4]nonane-2,4-dione
• IUPAC Traditional name: 6,6,8,8-tetramethyl-7-oxa-1,3-diazaspiro[4.4]nonane-2,4-dione
• Synonyms: 6,6,8,8-tetramethyl-7-oxa-1,3-diazaspiro[4.4]nonane-2,4-dione

Database IDs

• MDL Number: MFCD22392112
• PubChem SID: 164296219
• PubChem CID: 71756522

CALCULATED PROPERTIES

• Acid pKa: 9.5541525
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 0.07341853
• LogD (pH = 7.4): 0.07045647
• Log P: 0.07345642
• Molar Refractivity: 52.81 cm^3
• Polarizability: 20.879553 Å^3
• Polar Surface Area: 67.43 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.134

Product Information

• Purity: 95%