5-Methoxy-7,8-dimethyl-2-phenyl-2,3-dihydrochromen-4-one
Basic information
- CAS
2812-09-1- Standard SMILES
COc1cc(C)c(C)c2c1C(=O)CC(c1ccccc1)O2- InChIKey
HZLLFRKBXPNHCV-UHFFFAOYSA-N- Molecular formula
- C18H18O3
- Average molar mass
- 282.3 g/mol
- Monoisotopic mass
- 282.12559443
Names & identifiers
- Preferred name
- 5-Methoxy-7,8-dimethyl-2-phenyl-2,3-dihydrochromen-4-one
- IUPAC
- 5-methoxy-7,8-dimethyl-2-phenyl-2,3-dihydrochromen-4-one
Names & synonyms
2812-09-1HZLLFRKBXPNHCV-UHFFFAOYSA-NNS00048718
Database identifiers
- CAS
2812-09-1- PubChem CID
- 102883
- EC Number
- 220-557-5
- Nikkaji
- J306.750E
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 375
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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