Basic information
- CAS
114661-95-9- Standard SMILES
C=CCOc1cc(C(C)=O)c(OC)c2ccccc12- InChIKey
KZBUYQGRZMBMDU-UHFFFAOYSA-N- Molecular formula
- C16H16O3
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.10994437
Names & identifiers
- Preferred name
- Ethanone, 1-[1-methoxy-4-(2-propenyloxy)-2-naphthalenyl]-
- IUPAC
- 1-(1-methoxy-4-prop-2-enoxynaphthalen-2-yl)ethanone
Names & synonyms
114661-95-9Ethanone, 1-[1-methoxy-4-(2-propenyloxy)-2-naphthalenyl]-SCHEMBL23535529DTXSID504375891-{1-Methoxy-4-[(prop-2-en-1-yl)oxy]naphthalen-2-yl}ethan-1-one
Database identifiers
- CAS
114661-95-9- PubChem CID
- 10264382
- DTXSID
DTXSID50437589
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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