Basic information
- CAS
39079-58-8- Standard SMILES
C1CC(C2CO2)OCC1C1CO1- InChIKey
VOPZIIJKXUKTCS-UHFFFAOYSA-N- Molecular formula
- C9H14O3
- Average molar mass
- 170.21 g/mol
- Monoisotopic mass
- 170.0942943
Names & identifiers
- Preferred name
- 1,5:6,7-Dianhydro-2,3,4-trideoxy-2-oxiran-2-ylheptitol
- IUPAC
- 2,5-bis(oxiran-2-yl)oxane
- English name
- 2,5-Bis(oxiran-2-yl)tetrahydro-2H-pyran
- Molecular formula
- C9H14O3
- Molecular weight
- 170.21
Names & synonyms
1,5:6,7-dianhydro-2,3,4-trideoxy-2-oxiran-2-ylheptitol39079-58-8DTXSID70959899RefChem:1053480DTXCID6013877702,5-Di(1,2-epoxyethyl)tetrahydro-2H-pyran2H-Pyran, tetrahydro-2,5-bis(epoxyethyl)-1,5:6,7-Dianhydro-2,3,4-trideoxy-2-(oxiran-2-yl)heptitol2,5-Bis(oxiran-2-yl)tetrahydro-2H-pyran2H-Pyran, tetrahydro-2,5-bis(oxiranyl)- (9CI)
Database identifiers
- CAS
39079-58-8- PubChem CID
- 217635
- DTXSID
DTXSID70959899- Nikkaji
- J35.392B
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 34.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Boiling point
- 239.85 °C · 239.85°C (rough estimate)
- Density
- 1.0548 · 1.0548 (rough estimate)
- refractive index
- 1.451 · 1.4510 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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