[1-Methoxy-2-(oxan-2-yloxy)heptyl] acetate
Basic information
- CAS
7479-45-0- Standard SMILES
CCCCCC(OC1CCCCO1)C(OC)OC(C)=O- InChIKey
VYJJSAAIGBVYEF-UHFFFAOYSA-N- Molecular formula
- C15H28O5
- Average molar mass
- 288.38 g/mol
- Monoisotopic mass
- 288.19367399
Names & identifiers
- Preferred name
- [1-Methoxy-2-(oxan-2-yloxy)heptyl] acetate
- IUPAC
- [1-methoxy-2-(oxan-2-yloxy)heptyl] acetate
Names & synonyms
7479-45-0[1-methoxy-2-(oxan-2-yloxy)heptyl] acetateNSC401650DTXSID10322609NSC-4016501-Methoxy-2-[(oxan-2-yl)oxy]heptyl acetate
Database identifiers
- CAS
7479-45-0- PubChem CID
- 344628
- DTXSID
DTXSID10322609
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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