Tetra-t-butylperoxypyromellitate
Basic information
- CAS
63472-69-5- Standard SMILES
CC(C)(C)OOC(=O)c1cc(C(=O)OOC(C)(C)C)c(C(=O)OOC(C)(C)C)cc1C(=O)OOC(C)(C)C- InChIKey
KOAKWBXPXOTXGD-UHFFFAOYSA-N- Molecular formula
- C26H38O12
- Average molar mass
- 542.6 g/mol
- Monoisotopic mass
- 542.23632664
Names & identifiers
- Preferred name
- Tetra-t-butylperoxypyromellitate
- IUPAC
- tetratert-butyl benzene-1,2,4,5-tetracarboperoxoate
- English name
- Tetra-t-butylperoxypyromellitate
- Molecular formula
- C26H38O12
- Molecular weight
- 542.57
Names & synonyms
Tetra-t-butylperoxypyromellitate63472-69-5SCHEMBL6663425DTXSID60212889tetra-tert-butyl benzene-1,2,4,5-tetracarboperoxoate1,2,4,5-Benzenetetracarboperoxoic acid, 1,2,4,5-tetrakis(1,1-dimethylethyl) ester
Database identifiers
- CAS
63472-69-5- PubChem CID
- 144012
- DTXSID
DTXSID60212889
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 16
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 700
Physicochemical properties
- Melting point
- 114 °C · 114 °C
- Boiling point
- 664 · 664.0±55.0 °C(Predicted)
- Density
- 1.167 · 1.167±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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