2-(2-methylcyclopropyl)furan

• ChemBase ID: 250728
• Molecular Formular: C8H10O
• Molecular Mass: 122.1644
• Monoisotopic Mass: 122.07316494
• SMILES: C1(CC1C)c1occc1
• Canonical SMILES: CC1CC1c1ccco1
• InChI: InChI=1S/C8H10O/c1-6-5-7(6)8-3-2-4-9-8/h2-4,6-7H,5H2,1H3
• InChIKey: FKLFCFZEGVKNCT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(2-methylcyclopropyl)furan
• IUPAC Traditional name: 2-(2-methylcyclopropyl)furan
• Synonyms: 2-(2-methylcyclopropyl)furan

Database IDs

• MDL Number: MFCD02323193
• PubChem SID: 164306638
• PubChem CID: 16226805

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.0238411
• LogD (pH = 7.4): 2.0238411
• Log P: 2.0238411
• Molar Refractivity: 35.4631 cm^3
• Polarizability: 13.749085 Å^3
• Polar Surface Area: 13.14 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.78

Product Information

• Purity: 95%