Basic information
- CAS
65905-73-9- Standard SMILES
COC1=Cc2c(oc3c(C(C)(C)C)cc(OC)cc23)OC(C(C)(C)C)=C1- InChIKey
SHHQPQCJPVYDCF-UHFFFAOYSA-N- Molecular formula
- C22H28O4
- Average molar mass
- 356.5 g/mol
- Monoisotopic mass
- 356.19875937
Names & identifiers
- Preferred name
- 2,9-Di-tert-butyl-4,7-dimethoxyoxepino[2,3-b][1]benzofuran
- IUPAC
- 2,9-ditert-butyl-4,7-dimethoxyoxepino[2,3-b][1]benzofuran
Names & synonyms
65905-73-9NSC311342DTXSID103171162,9-Di-tert-butyl-4,7-dimethoxyoxepino[2,3-b][1]benzofuranNSC-311342
Database identifiers
- CAS
65905-73-9- PubChem CID
- 329326
- DTXSID
DTXSID10317116
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 40.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 578
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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