Furanodienone
Properties
- Molecular formula
- C15H18O2
- Molar mass
- 230.31 g/mol
- Exact mass
- 230.1307 Da
- Melting point
- 83–84 °C
- Boiling point
- 89.5–90.5 °C
- logP
- 4.00Crippen estimate
- Polar surface area
- 30.2 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 0
Identifiers
CAS number
24268-41-5SMILES
C/C1=CC(=O)c2c(C)coc2C/C(C)=C/CC1InChIKey
XVOHELPNOXGRBQ-NXAIOARDSA-NInChI
InChI=1S/C15H18O2/c1-10-5-4-6-11(2)8-14-15(13(16)7-10)12(3)9-17-14/h6-7,9H,4-5,8H2,1-3H3/b10-7+,11-6+Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Cyclodeca[b]furan-4(7H)-one, 8,11-dihydro-3,6,10-trimethyl-, (5E,9E)-
- Germacra-1(10),4,7,11-tetraen-6-one, 8,12-epoxy-, (E,E)-
- Cyclodeca[b]furan-4(7H)-one, 8,11-dihydro-3,6,10-trimethyl-, (E,E)-
- (5E,9E)-8,11-Dihydro-3,6,10-trimethylcyclodeca[b]furan-4(7H)-one
- Furanodienon
- (1(10)E,4E)-8,12-Epoxygermacra-1(10),4,7,11-tetraen-6-one
- (1E,4E)-8,12-Epoxygermacra-1(10),4,7,11-tetraen-6-one
Work with Furanodienone
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern