3,6-Dioxabicyclo[3.1.0]hexane
Properties
- Molecular formula
- C4H6O2
- Molar mass
- 86.09 g/mol
- Exact mass
- 86.0368 Da
- Boiling point
- 143–144 °C
- logP
- -0.22Crippen estimate
- Polar surface area
- 21.8 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 0
Identifiers
CAS number
285-69-8SMILES
C1OCC2OC12InChIKey
AIUTZIYTEUMXGG-UHFFFAOYSA-NInChI
InChI=1S/C4H6O2/c1-3-4(6-3)2-5-1/h3-4H,1-2H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Furan, 3,4-epoxytetrahydro-
- 3,4-Epoxytetrahydrofuran
- NSC 196231
Work with 3,6-Dioxabicyclo[3.1.0]hexane
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
Similar compounds
4,4-Dimethyl-3,5,8-trioxabicyclo[5.1.0]octane57280-22-540 % similar
Cyclopentene oxide285-67-638 % similar
Glycerol triglycidyl ether13236-02-735 % similar
3-Oxetanamine21635-88-135 % similar
Diglycidyl ether2238-07-535 % similar
3-Iodooxetane26272-85-535 % similar
Cyclooctene oxide286-62-435 % similar
13-Oxabicyclo[10.1.0]tridecane286-99-735 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds