Geranyl ethyl ether
Properties
- Molecular formula
- C12H22O
- Molar mass
- 182.31 g/mol
- Exact mass
- 182.1671 Da
- Density
- 0.864 g/mL (at 25 °C)
- Boiling point
- 218 °C
- logP
- 3.72Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 6
Identifiers
CAS number
40267-72-9SMILES
CCOCC=C(C)CCC=C(C)CInChIKey
LOUIMJFJROISMD-UHFFFAOYSA-NInChI
InChI=1S/C12H22O/c1-5-13-10-9-12(4)8-6-7-11(2)3/h7,9H,5-6,8,10H2,1-4H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- 2,6-Octadiene, 1-ethoxy-3,7-dimethyl-
- 1-Ethoxy-3,7-dimethyl-2,6-octadiene
- Ethyl geranyl ether
- 2,6-Dimethyl-8-ethoxy-2,6-octadiene
Work with Geranyl ethyl ether
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