Basic information
- Standard SMILES
CC1(C)CC(=O)c2cc(OCc3ccccc3)ccc2O1- InChIKey
XWROIWDXQLSBBR-UHFFFAOYSA-N- Molecular formula
- C18H18O3
- Average molar mass
- 282.3 g/mol
Names & identifiers
- Preferred name
- 6-Benzyloxy-2,2-dimethylchroman-4-one
- IUPAC
- 2,2-dimethyl-6-phenylmethoxy-3H-chromen-4-one
Names & synonyms
SCHEMBL6604268XWROIWDXQLSBBR-UHFFFAOYSA-NAKOS0140265226-Benzyloxy-2,2-dimethylchroman-4-one
Database identifiers
- PubChem CID
- 11780992
- Nikkaji
- J1.108.591A
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 371
Related reactions
10 records
Compound notes
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