Basic information
- CAS
64218-01-5- Standard SMILES
CC(=CCOC1CCCCO1)CCC=O- InChIKey
HYTPKOQITCEXLW-UHFFFAOYSA-N- Molecular formula
- C12H20O3
- Average molar mass
- 212.28 g/mol
- Monoisotopic mass
- 212.1412445
Names & identifiers
- Preferred name
- 4-Methyl-6-(oxan-2-yloxy)hex-4-enal
- IUPAC
- 4-methyl-6-(oxan-2-yloxy)hex-4-enal
Names & synonyms
4-methyl-6-(oxan-2-yloxy)hex-4-enal64218-01-5DTXSID403398264-Methyl-6-[(oxan-2-yl)oxy]hex-4-enal
Database identifiers
- CAS
64218-01-5- PubChem CID
- 559017
- DTXSID
DTXSID40339826
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 211
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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