1-(tert-Butyldioxy)-3-propoxy-2-propanol
Basic information
- CAS
38578-22-2- Standard SMILES
CCCOCC(O)COOC(C)(C)C- InChIKey
KLSFNXMIRGINHI-UHFFFAOYSA-N- Molecular formula
- C10H22O4
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.15180918
Names & identifiers
- Preferred name
- 1-(tert-Butyldioxy)-3-propoxy-2-propanol
- IUPAC
- 1-tert-butylperoxy-3-propoxypropan-2-ol
- English name
- 1-(tert-Bbutyldioxy)-3-propoxy-2-propanol
- Molecular formula
- C10H22O4
- Molecular weight
- 206.28
Names & synonyms
38578-22-21-(tert-Butyldioxy)-3-propoxy-2-propanol1-(tert-Bbutyldioxy)-3-propoxy-2-propanolDTXSID509594381-(TERT-BUTYLPEROXY)-3-PROPOXYPROPAN-2-OL2-Propanol, 1-[(1,1-dimethylethyl)dioxy]-3-propoxy-
Database identifiers
- CAS
38578-22-2- PubChem CID
- 142292
- DTXSID
DTXSID50959438
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 131
Physicochemical properties
- Boiling point
- 264.5 · 264.5±30.0 °C(Predicted)
- Density
- 0.9624 g/cm3 · 0.9624 g/cm3
- pka
- 13.7 · 13.70±0.20(Predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…