6-Ethyl-3-(2-methylpropyl)-2H-pyran-2-one
Basic information
- CAS
17654-99-8- Standard SMILES
CCc1ccc(CC(C)C)c(=O)o1- InChIKey
MKZUGSPKAYXMHH-UHFFFAOYSA-N- Molecular formula
- C11H16O2
- Average molar mass
- 180.24 g/mol
- Monoisotopic mass
- 180.11502975
Overview
Mucidone is a pyranone.
Names & identifiers
- Preferred name
- 6-Ethyl-3-(2-methylpropyl)-2H-pyran-2-one
- IUPAC
- 6-ethyl-3-(2-methylpropyl)pyran-2-one
- English name
- mucidone
- Molecular weight
- 0
Names & synonyms
Mucidone17654-99-86-ethyl-3-(2-methylpropyl)pyran-2-one3-Isobutyl-6-ethyl-alpha-pyrone6-ethyl-3-(2-methylpropyl)-2h-pyran-2-oneDTXSID30938807RefChem:913926DTXCID6013673282H-Pyran-2-one, 6-ethyl-3-(2-methylpropyl)-CHEMBL3967990SCHEMBL16431158CHEBI:197683
Database identifiers
- CAS
17654-99-8- PubChem CID
- 167669
- DTXSID
DTXSID30938807- ChEMBL
CHEMBL3967990- ChEBI
CHEBI:197683- Nikkaji
- J13.357D
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…