Basic information
- Standard SMILES
C=CCC(C=Cc1ccccc1)OCC- InChIKey
WTTVTGXLZBPQGO-UHFFFAOYSA-N- Molecular formula
- C14H18O
- Average molar mass
- 202.29 g/mol
- Monoisotopic mass
- 202.13576519
Names & identifiers
- Preferred name
- 3-Ethoxy-hexa-1,5-dienyl-benzene
- IUPAC
- 3-ethoxyhexa-1,5-dienylbenzene
Names & synonyms
3-ethoxy-hexa-1,5-dienyl-benzeneDTXSID901359489
Database identifiers
- PubChem CID
- 595191
- DTXSID
DTXSID901359489
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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