2-(2,5,7,8-Tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)ethyl 4-methylbenzenesulfonate
Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)OCCC2(C)CCc3c(C)c(OCc4ccccc4)c(C)c(C)c3O2)cc1- InChIKey
QHZOCKCDZNOVPR-UHFFFAOYSA-N- Molecular formula
- C29H34O5S
- Average molar mass
- 494.6 g/mol
Names & identifiers
- Preferred name
- 2-(2,5,7,8-Tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)ethyl 4-methylbenzenesulfonate
- IUPAC
- 2-(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)ethyl 4-methylbenzenesulfonate
Names & synonyms
SCHEMBL11445076QHZOCKCDZNOVPR-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 14657166
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 764
Related reactions
3 records
Compound notes
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