3-[(Oxan-2-yl)oxy]azetidine
Basic information
- CAS
764644-39-5- Standard SMILES
C1CCC(OC2CNC2)OC1- InChIKey
YKDDQZIHCBQOOJ-UHFFFAOYSA-N- Molecular formula
- C8H15NO2
- Average molar mass
- 157.21 g/mol
- Monoisotopic mass
- 157.11027872
Names & identifiers
- Preferred name
- 3-[(Oxan-2-yl)oxy]azetidine
- IUPAC
- 3-(oxan-2-yloxy)azetidine
- English name
- Azetidine, 3-[(tetrahydro-2H-pyran-2-yl)oxy]- (9CI)
- Molecular formula
- C8H15NO2
- Molecular weight
- 157.21
Names & synonyms
3-(oxan-2-yloxy)azetidine764644-39-53-[(Oxan-2-yl)oxy]azetidine3-((Tetrahydro-2H-pyran-2-yl)oxy)azetidineSCHEMBL48893DTXSID40621273DB-273490EN300-1996343AZETIDINE, 3-[(TETRAHYDRO-2H-PYRAN-2-YL)OXY]-Azetidine, 3-[(tetrahydro-2H-pyran-2-yl)oxy]- (9CI)
Database identifiers
- CAS
764644-39-5- PubChem CID
- 21990146
- DTXSID
DTXSID40621273
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 125
Physicochemical properties
- Boiling point
- 241.4 · 241.4±40.0 °C(Predicted)
- Density
- 1.08 · 1.08±0.1 g/cm3(Predicted)
- pka
- 9.47 · 9.47±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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