3-methyl-2,3-dihydrofuran

• ChemBase ID: 290048
• Molecular Formular: C5H8O
• Molecular Mass: 84.11642
• Monoisotopic Mass: 84.05751488
• SMILES: CC1COC=C1
• Canonical SMILES: CC1COC=C1
• InChI: InChI=1S/C5H8O/c1-5-2-3-6-4-5/h2-3,5H,4H2,1H3
• InChIKey: GLXIOXNPORODGG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-methyl-2,3-dihydrofuran
• IUPAC Traditional name: 3-methyl-2,3-dihydrofuran
• Synonyms: 3-Methyl-2,3-dihydrofuran

Database IDs

• CAS Number: 1708-27-6
• PubChem SID: 180675579
• PubChem CID: 102677

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.90729874
• LogD (pH = 7.4): 0.90729874
• Log P: 0.90729874
• Molar Refractivity: 25.1182 cm^3
• Polarizability: 9.660139 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%