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
Hazards
Warning
- H226 Flammable liquid and vapor80% of notifiers
- H302 Harmful if swallowed20% of notifiers
- H315 Causes skin irritation40% of notifiers
- H319 Causes serious eye irritation40% of notifiers
- H335 May cause respiratory irritation40% of notifiers
Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
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
Cyclohexene oxide286-20-438 % similar
Triglycidylglycerol13236-02-735 % similar
3-Oxetanamine21635-88-135 % similar
Diglycidyl ether2238-07-535 % similar
3-Iodooxetane26272-85-535 % similar
Cyclooctene oxide286-62-435 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.