Basic information
- CAS
113538-82-2- Standard SMILES
C=Cc1ccc(CCCCOCC2CO2)cc1- InChIKey
NAWAGPRWJALDDF-UHFFFAOYSA-N- Molecular formula
- C15H20O2
- Average molar mass
- 232.32 g/mol
- Monoisotopic mass
- 232.14632988
Names & identifiers
- Preferred name
- 2-[[4-(4-Ethenylphenyl)butoxy]methyl]oxirane
- IUPAC
- 2-[4-(4-ethenylphenyl)butoxymethyl]oxirane
Names & synonyms
2-[[4-(4-Ethenylphenyl)butoxy]methyl]oxirane2-{[4-(4-Ethenylphenyl)butoxy]methyl}oxiraneDTXSID801256157113538-82-2
Database identifiers
- CAS
113538-82-2- PubChem CID
- 85545935
- DTXSID
DTXSID801256157
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 21.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 219
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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