3-Butyl-5,6-dihydro-2H-pyran-2-one
Basic information
- CAS
138118-29-3- Standard SMILES
CCCCC1=CCCOC1=O- InChIKey
SUOQGDJUJPKVEE-UHFFFAOYSA-N- Molecular formula
- C9H14O2
- Average molar mass
- 154.21 g/mol
- Monoisotopic mass
- 154.09937969
Names & identifiers
- Preferred name
- 3-Butyl-5,6-dihydro-2H-pyran-2-one
- IUPAC
- 5-butyl-2,3-dihydropyran-6-one
Names & synonyms
138118-29-33-Butyl-5,6-dihydro-2H-pyran-2-oneDTXSID10567255
Database identifiers
- CAS
138118-29-3- PubChem CID
- 15033367
- DTXSID
DTXSID10567255
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 170
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…