Basic information
- CAS
29619-33-8- Standard SMILES
CC(C)(C)c1cc2c(c(C(C)(C)C)c1)OCO2- InChIKey
IIZFCDYTAOAJGJ-UHFFFAOYSA-N- Molecular formula
- C15H22O2
- Average molar mass
- 234.33 g/mol
- Monoisotopic mass
- 234.16197994
Names & identifiers
- Preferred name
- 4,6-Di-tert-butyl-2H-1,3-benzodioxole
- IUPAC
- 4,6-ditert-butyl-1,3-benzodioxole
Names & synonyms
29619-33-84,6-Di-tert-butyl-2H-1,3-benzodioxoleDTXSID30538260RefChem:285722DTXCID904890474,6-Di-tert-butylbenzo[d][1,3]dioxoleSCHEMBL99790604,6-di(t-butyl)-1,3-benzodioxoleSY309822
Database identifiers
- CAS
29619-33-8- PubChem CID
- 13360730
- DTXSID
DTXSID30538260- Nikkaji
- J2.901.271G
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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