1,5,6,6-Tetraethoxy-3-hexanone
Basic information
- CAS
56667-13-1- Standard SMILES
CCOCCC(=O)CC(OCC)C(OCC)OCC- InChIKey
KLOQZBNONOHIHT-UHFFFAOYSA-N- Molecular formula
- C14H28O5
- Average molar mass
- 276.37 g/mol
- Monoisotopic mass
- 276.19367399
Names & identifiers
- Preferred name
- 1,5,6,6-Tetraethoxy-3-hexanone
- IUPAC
- 1,5,6,6-tetraethoxyhexan-3-one
- English name
- 1,5,6,6-Tetraethoxy-3-hexanone
- Molecular weight
- 0
Names & synonyms
1,5,6,6-Tetraethoxy-3-hexanone56667-13-1DTXSID20340910RefChem:221120DTXCID002919911,5,6,6-tetraethoxyhexan-3-oneDB-311537
Database identifiers
- CAS
56667-13-1- PubChem CID
- 568465
- DTXSID
DTXSID20340910- Nikkaji
- J113.776J
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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