2(3H)-Furanone, dihydro-3-isopropyl-5-methyl-3-(2-pyridyl)-
Basic information
- CAS
71824-65-2- Standard SMILES
CC1CC(c2ccccn2)(C(C)C)C(=O)O1- InChIKey
DYBBJMHFHMUXOT-UHFFFAOYSA-N- Molecular formula
- C13H17NO2
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.12592879
Names & identifiers
- Preferred name
- 2(3H)-Furanone, dihydro-3-isopropyl-5-methyl-3-(2-pyridyl)-
- IUPAC
- 5-methyl-3-propan-2-yl-3-pyridin-2-yloxolan-2-one
Names & synonyms
71824-65-22(3H)-FURANONE, DIHYDRO-3-ISOPROPYL-5-METHYL-3-(2-PYRIDYL)-RefChem:10587463-Isopropyl-5-methyl-3-(pyridin-2-yl)dihydrofuran-2(3H)-oneBRN 11150243-Isopropyl-5-methyl-3-(2-pyridyl)dihydro-2(3H)-furanone3-(Pyridyl-2')-3-isopropyl-5-methyltetrahydrofuran-2-one5-Methyl-3-(propan-2-yl)-3-(pyridin-2-yl)oxolan-2-oneDTXSID00992532
Database identifiers
- CAS
71824-65-2- PubChem CID
- 51434
- DTXSID
DTXSID00992532- Nikkaji
- J75.502H
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 277
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Compound notes
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