Basic information
- Standard SMILES
COc1ccc(COc2ccc3c(c2)OC(C)(C)C3c2ccc(C(C)C)cc2)cc1- InChIKey
ZQGGBEYKUAHKIW-UHFFFAOYSA-N- Molecular formula
- C27H30O3
- Average molar mass
- 402.5 g/mol
- Monoisotopic mass
- 402.21949481
Names & identifiers
- Preferred name
- 3-(4-Isopropylphenyl)-6-(4-methoxybenzyloxy)-2,2-dimethyl-2,3-dihydrobenzofuran
- IUPAC
- 6-[(4-methoxyphenyl)methoxy]-2,2-dimethyl-3-(4-propan-2-ylphenyl)-3H-1-benzofuran
Names & synonyms
SCHEMBL2914026ZQGGBEYKUAHKIW-UHFFFAOYSA-N3-(4-Isopropylphenyl)-6-(4-methoxybenzyloxy)-2,2-dimethyl-2,3-dihydrobenzofuran
Database identifiers
- PubChem CID
- 10179256
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 528
Related reactions
2 records
Compound notes
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