(2R)-2-(prop-1-en-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one

• ChemBase ID: 206240
• Molecular Formular: C14H12O3
• Molecular Mass: 228.24328
• Monoisotopic Mass: 228.07864424
• SMILES: O1c2c(C[C@@H]1C(=C)C)cc1c(oc(=O)cc1)c2
• Canonical SMILES: CC(=C)[C@H]1Cc2c(O1)cc1c(c2)ccc(=O)o1
• InChI: InChI=1S/C14H12O3/c1-8(2)11-6-10-5-9-3-4-14(15)17-12(9)7-13(10)16-11/h3-5,7,11H,1,6H2,2H3/t11-/m1/s1
• InChIKey: VMWUHWZFDITAOL-LLVKDONJSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2R)-2-(prop-1-en-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one
• IUPAC Traditional name: (2R)-2-(prop-1-en-2-yl)-2H,3H-furo[3,2-g]chromen-7-one

Database IDs

• PubChem SID: 164262150
• PubChem CID: 759292

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 2.699955
• LogD (pH = 7.4): 2.699955
• Log P: 2.699955
• Molar Refractivity: 64.4363 cm^3
• Polarizability: 24.529636 Å^3
• Polar Surface Area: 35.53 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Classification: Genuine Natural Compounds