Basic information
- CAS
15360-01-7- Standard SMILES
CC(C)(C)Oc1ccc(OC(C)(C)C)cc1- InChIKey
FMDDSXFJMWQYTJ-UHFFFAOYSA-N- Molecular formula
- C14H22O2
- Average molar mass
- 222.32 g/mol
- Monoisotopic mass
- 222.16197994
Names & identifiers
- Preferred name
- Benzene, 1,4-bis(1,1-dimethylethoxy)-
- IUPAC
- 1,4-bis[(2-methylpropan-2-yl)oxy]benzene
- English name
- 1,4-Di-tert-butoxybenzene
- Molecular formula
- C14H22O2
- Molecular weight
- 222.32
Names & synonyms
15360-01-7Benzene, 1,4-bis(1,1-dimethylethoxy)-DTXSID00341586RefChem:1078225DTXCID202926671,4-Di-tert-butoxybenzeneBenzene, p-di-tert-butoxy-1,4-bis[(2-methylpropan-2-yl)oxy]benzeneSCHEMBL267461,4-Ditert-butoxybenzene #SCHEMBL3059376FMDDSXFJMWQYTJ-UHFFFAOYSA-N
Database identifiers
- CAS
15360-01-7- PubChem CID
- 574161
- DTXSID
DTXSID00341586- Nikkaji
- J102.804I
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Melting point
- 77 °C · 77 °C
- Boiling point
- 289.7 · 289.7±13.0 °C(Predicted)
- Density
- 0.939 · 0.939±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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