2-[3-(Dimethylamino)-2-hydroxypropyl]isoindole-1,3-dione
Basic information
- CAS
92108-82-2- Standard SMILES
CN(C)CC(O)CN1C(=O)c2ccccc2C1=O- InChIKey
XCLJRVUDGMRNMC-UHFFFAOYSA-N- Molecular formula
- C13H16N2O3
- Average molar mass
- 248.28 g/mol
- Monoisotopic mass
- 248.11609238
Names & identifiers
- Preferred name
- 2-[3-(Dimethylamino)-2-hydroxypropyl]isoindole-1,3-dione
- IUPAC
- 2-[3-(dimethylamino)-2-hydroxypropyl]isoindole-1,3-dione
Names & synonyms
92108-82-22-[3-(dimethylamino)-2-hydroxypropyl]isoindole-1,3-dione2-[3-(Dimethylamino)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dioneNSC233915SCHEMBL12626324DTXSID903108822-(3-(Dimethylamino)-2-hydroxypropyl)isoindoline-1,3-dioneNSC-233915DB-392367
Database identifiers
- CAS
92108-82-2- PubChem CID
- 314665
- DTXSID
DTXSID90310882
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 319
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Compound notes
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