6-Bromo-4-tert-butyl-7-methoxy-2,2-dimethyl-2H-chromene
Basic information
- Standard SMILES
COc1cc2c(cc1Br)C(C(C)(C)C)=CC(C)(C)O2- InChIKey
ADRNSBUUIMLURW-UHFFFAOYSA-N- Molecular formula
- C16H21BrO2
- Average molar mass
- 325.24 g/mol
Names & identifiers
- Preferred name
- 6-Bromo-4-tert-butyl-7-methoxy-2,2-dimethyl-2H-chromene
- IUPAC
- 6-bromo-4-tert-butyl-7-methoxy-2,2-dimethylchromene
Names & synonyms
SCHEMBL6280858ADRNSBUUIMLURW-UHFFFAOYSA-N6-Bromo-4-tert-butyl-7-methoxy-2,2-dimethyl-2H-chromene
Database identifiers
- PubChem CID
- 22490933
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 367
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
3 records
Compound notes
Loading…