Basic information
- CAS
5451-26-3- Standard SMILES
CCCCCCCC(=O)OCCCC1CCCO1- InChIKey
KVUNWOCBMHOMRS-UHFFFAOYSA-N- Molecular formula
- C15H28O3
- Average molar mass
- 256.38 g/mol
- Monoisotopic mass
- 256.20384475
Names & identifiers
- Preferred name
- 3-(Tetrahydrofuran-2-yl)propyl octanoate
- IUPAC
- 3-(oxolan-2-yl)propyl octanoate
Names & synonyms
3-(tetrahydrofuran-2-yl)propyl octanoate5451-26-33-(oxolan-2-yl)propyl octanoateNSC18543DTXSID20280761NSC-18543
Database identifiers
- CAS
5451-26-3- PubChem CID
- 227199
- DTXSID
DTXSID20280761
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 216
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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