2-[4-(2,2,6,6-Tetramethylpiperidin-1-yl)but-2-ynoxy]isoindole-1,3-dione
Basic information
- CAS
83108-16-1- Standard SMILES
CC1(C)CCCC(C)(C)N1CC#CCON1C(=O)c2ccccc2C1=O- InChIKey
MFLUOQJDBCDXCW-UHFFFAOYSA-N- Molecular formula
- C21H26N2O3
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.1943427
Names & identifiers
- Preferred name
- 2-[4-(2,2,6,6-Tetramethylpiperidin-1-yl)but-2-ynoxy]isoindole-1,3-dione
- IUPAC
- 2-[4-(2,2,6,6-tetramethylpiperidin-1-yl)but-2-ynoxy]isoindole-1,3-dione
Names & synonyms
NSC36124683108-16-1DTXSID10320549NSC-3612462-{[4-(2,2,6,6-Tetramethylpiperidin-1-yl)but-2-yn-1-yl]oxy}-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
83108-16-1- PubChem CID
- 338467
- DTXSID
DTXSID10320549
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 600
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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