Basic information
- CAS
10312-36-4- Standard SMILES
CCN(CC)C(=O)CCCN1C(=O)c2ccccc2C1=O- InChIKey
NCCXKYUWIXTJAF-UHFFFAOYSA-N- Molecular formula
- C16H20N2O3
- Average molar mass
- 288.34 g/mol
- Monoisotopic mass
- 288.1473925
Names & identifiers
- Preferred name
- N,N-Diethyl-1,3-dioxo-2-isoindolinebutyramide
- IUPAC
- 4-(1,3-dioxoisoindol-2-yl)-N,N-diethylbutanamide
- English name
- N,N-Diethyl-1,3-dioxo-2-isoindolinebutyramide
- Molecular formula
- C16H20N2O3
- Molecular weight
- 288.34
Names & synonyms
N,N-Diethyl-1,3-dioxo-2-isoindolinebutyramide10312-36-42-ISOINDOLINEBUTYRAMIDE, N,N-DIETHYL-1,3-DIOXO-N,N-Diethyl-1,3-dihydro-1,3-dioxo-2H-isoindole-2-butanamideNSC-455032H-Isoindole-2-butanamide, N,N-diethyl-1,3-dihydro-1,3-dioxo-4-(1,3-dioxoisoindol-2-yl)-N,N-diethylbutanamideNSC 45503BRN 1543003Phthalimide, N-(diethylcarbamoylpropyl)-1,3-Dioxo-N-diethyl-2-isoindolinebutyramideNSC45503
Show more names
DTXSID3014565074896AJW5SAKOS0041078634-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)-N,N-diethylbutanamide
Database identifiers
- CAS
10312-36-4- PubChem CID
- 25147
- DTXSID
DTXSID30145650- UNII
- 74896AJW5S
- Nikkaji
- J68.618B
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 394
Physicochemical properties
- Melting point
- 81 · 81-82 °C
- Boiling point
- 446.9 · 446.9±28.0 °C(Predicted)
- Density
- 1.183 · 1.183±0.06 g/cm3(Predicted)
- pka
- -0.48 · -0.48±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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