Basic information
- CAS
88730-59-0- Standard SMILES
COC(=O)CC=CCCOC1CCCCO1- InChIKey
RSBWRUCFSBBMKB-UHFFFAOYSA-N- Molecular formula
- C12H20O4
- Average molar mass
- 228.28 g/mol
- Monoisotopic mass
- 228.13615911
Names & identifiers
- Preferred name
- Methyl 6-[(oxan-2-yl)oxy]hex-3-enoate
- IUPAC
- methyl 6-(oxan-2-yloxy)hex-3-enoate
Names & synonyms
88730-59-0Methyl 6-[(oxan-2-yl)oxy]hex-3-enoateSCHEMBL11069681DTXSID70710301
Database identifiers
- CAS
88730-59-0- PubChem CID
- 54282985
- DTXSID
DTXSID70710301
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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