3-Decyloxymethyl-7-oxabicyclo[4.1.0]heptane
Basic information
- Standard SMILES
CCCCCCCCCCOCC1CCC2OC2C1- InChIKey
BIXPTULPJFDWIS-UHFFFAOYSA-N- Molecular formula
- C17H32O2
- Average molar mass
- 268.4 g/mol
- Monoisotopic mass
- 268.24023026
Names & identifiers
- Preferred name
- 3-Decyloxymethyl-7-oxabicyclo[4.1.0]heptane
- IUPAC
- 3-(decoxymethyl)-7-oxabicyclo[4.1.0]heptane
Names & synonyms
SCHEMBL5278688BIXPTULPJFDWIS-UHFFFAOYSA-N3-decyloxymethyl-7-oxabicyclo[4.1.0]heptane
Database identifiers
- PubChem CID
- 22222995
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 21.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 229
Related reactions
1 records
Compound notes
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