Basic information
- CAS
67080-30-2- Standard SMILES
CCOC1=Cc2c(oc3c(C(C)(C)C)cc(OCC)cc23)OC(C(C)(C)C)=C1- InChIKey
LXTLOAJVIMOBBS-UHFFFAOYSA-N- Molecular formula
- C24H32O4
- Average molar mass
- 384.5 g/mol
- Monoisotopic mass
- 384.2300595
Names & identifiers
- Preferred name
- 2,9-Di-tert-butyl-4,7-diethoxyoxepino[2,3-b][1]benzofuran
- IUPAC
- 2,9-ditert-butyl-4,7-diethoxyoxepino[2,3-b][1]benzofuran
Names & synonyms
67080-30-2NSC315853DTXSID603174642,9-Di-tert-butyl-4,7-diethoxyoxepino[2,3-b][1]benzofuranNSC-315853Oxepino[2, 2,9-bis(1,1-dimethylethyl)-4,7-diethoxy-
Database identifiers
- CAS
67080-30-2- PubChem CID
- 330101
- DTXSID
DTXSID60317464
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 40.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 607
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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