Basic information
- CAS
21578-94-9- Standard SMILES
CC(C)(C)OOC(=O)c1ccc(C(=O)OOC(C)(C)C)cc1- InChIKey
MEBDAPKZBGYVCA-UHFFFAOYSA-N- Molecular formula
- C16H22O6
- Average molar mass
- 310.34 g/mol
- Monoisotopic mass
- 310.14163842
Names & identifiers
- Preferred name
- Bis(1,1-dimethylethyl) dioxyterephthalate
- IUPAC
- ditert-butyl benzene-1,4-dicarboperoxoate
- English name
- bis(1,1-dimethylethyl) dioxyterephthalate
- Molecular formula
- C16H22O6
- Molecular weight
- 310.34
Names & synonyms
21578-94-9Bis(1,1-dimethylethyl) dioxyterephthalateSCHEMBL11126724DTXSID10944183MEBDAPKZBGYVCA-UHFFFAOYSA-NEINECS 244-451-3NS00050321Diperoxyterephthalic acid di-tert-butyl esterBenzene-1,4-di(peroxycarboxylic acid)di-tert-butyl ester1,4-Benzenedicarboperoxoic acid, 1,4-bis(1,1-dimethylethyl) ester
Database identifiers
- CAS
21578-94-9- PubChem CID
- 88949
- DTXSID
DTXSID10944183- EC Number
- 244-451-3
- Nikkaji
- J127.883E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 344
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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