Basic information
- Standard SMILES
C=CC(=O)C=C.C=CC(=O)CCCc1cccc(OC)c1- InChIKey
SOSORTFJCNLOTQ-UHFFFAOYSA-N- Molecular formula
- C18H22O3
- Average molar mass
- 286.4 g/mol
Names & identifiers
- Preferred name
- Vinyl ketone 6-(m-methoxyphenyl)-1-hexen-3-one
- IUPAC
- 6-(3-methoxyphenyl)hex-1-en-3-one;penta-1,4-dien-3-one
Names & synonyms
SCHEMBL11870626SOSORTFJCNLOTQ-UHFFFAOYSA-Nvinyl ketone 6-(m-methoxyphenyl)-1-hexen-3-one
Database identifiers
- PubChem CID
- 21485800
Properties
Computed structural properties
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 283
Related reactions
2 records
Compound notes
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