3-(3-Methoxyphenyl)-1-(naphthalen-2-yl)prop-2-en-1-one
Basic information
- CAS
57221-67-7- Standard SMILES
COc1cccc(C=CC(=O)c2ccc3ccccc3c2)c1- InChIKey
MWIFCBMBFRJMBC-UHFFFAOYSA-N- Molecular formula
- C20H16O2
- Average molar mass
- 288.3 g/mol
- Monoisotopic mass
- 288.11502975
Names & identifiers
- Preferred name
- 3-(3-Methoxyphenyl)-1-(naphthalen-2-yl)prop-2-en-1-one
- IUPAC
- 3-(3-methoxyphenyl)-1-naphthalen-2-ylprop-2-en-1-one
Names & synonyms
DTXSID901212023AKOS0343803253-(3-Methoxyphenyl)-1-(2-naphthalenyl)-2-propen-1-one3-(3-methoxyphenyl)-1-(naphthalen-2-yl)prop-2-en-1-one57221-67-7
Database identifiers
- CAS
57221-67-7- PubChem CID
- 72079569
- DTXSID
DTXSID901212023
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 401
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Compound notes
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