Rel-(2R,2′R)-2,2′-bioxirane
Properties
- Molecular formula
- C4H6O2
- Molar mass
- 86.09 g/mol
- Exact mass
- 86.0368 Da
- Melting point
- 3 °C
- Boiling point
- 144 °C
- logP
- -0.22Crippen estimate
- Polar surface area
- 25.1 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
- Stereocentres
- S, Sin SMILES atom order
Identifiers
CAS number
298-18-0SMILES
C1O[C@@H]1[C@@H]1CO1InChIKey
ZFIVKAOQEXOYFY-SEFKMRKONA-NInChI
InChI=1/C4H6O2/c1-3(5-1)4-2-6-4/h3-4H,1-2H2/t3-,4-/s2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 2,2′-Bioxirane, (2R,2′R)-rel-
- Butane, 1,2:3,4-diepoxy-, (±)-
- Threitol, 1,2:3,4-dianhydro-, DL-
- 2,2′-Bioxirane, (R*,R*)-(±)-
- Dl-1,2:3,4-Diepoxybutane
- 2,2′-Bioxirane, (R*,R*)-
- (±)-1,2:3,4-Diepoxybutane
- DL-Diepoxybutane
- (±)-Diepoxybutane
- rac-1,3-Butadiene diepoxide
Work with Rel-(2R,2′R)-2,2′-bioxirane
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
Glycidaldehyde diethyl acetal13269-77-744 % similar
Dimethyl isosorbide5306-85-439 % similar
Vinylcyclohexene dioxide106-87-638 % similar
1,2:5,6-Diepoxyhexane1888-89-733 % similar
Levoglucosan498-07-732 % similar
Glycerol triglycidyl ether13236-02-731 % similar
(+)-Propylene oxide15448-47-231 % similar
(2S)-2-Methyloxirane16088-62-331 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds