N,N-dimethylsulfonamide

• ChemBase ID: 797064
• Molecular Formular: C2H6NO2S
• Molecular Mass: 108.13954
• Monoisotopic Mass: 108.01192444
• SMILES: [S](=O)(=O)N(C)C
• Canonical SMILES: CN([S](=O)=O)C
• InChI: InChI=1S/C2H7NO2S/c1-3(2)6(4)5/h6H,1-2H3
• InChIKey: LVRCEUVOXCJYSV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,N-dimethylsulfonamide
• IUPAC Traditional name: N,N-dimethylsulfonamide
• Synonyms: N,N-DiMethylsulfaMide

Database IDs

• CAS Number: 3984-14-3

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.6261
• LogD (pH = 7.4): -0.6261
• Log P: -0.6261
• Molar Refractivity: 23.335 cm^3
• Polarizability: 9.828679 Å^3
• Polar Surface Area: 37.38 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%