| Identification | Back Directory | [Name]
2-(3-oxobutyl)isoindoline-1,3-dione | [CAS]
3783-77-5 | [Synonyms]
2-(3-oxobutyl)isoindole-1,3-dione
2-(3-oxobutyl)isoindoline-1,3-dione
2-(3-ketobutyl)isoindoline-1,3-quinone
1H-Isoindole-1,3(2H)-dione, 2-(3-oxobutyl)- | [Molecular Formula]
C12H11NO3 | [MDL Number]
MFCD00458653 | [MOL File]
3783-77-5.mol | [Molecular Weight]
217.22 |
| Chemical Properties | Back Directory | [Melting point ]
110 °C(Solv: ethanol, 50% (64-17-5)) | [Boiling point ]
366.8±25.0 °C(Predicted) | [density ]
1.275±0.06 g/cm3(Predicted) | [storage temp. ]
Inert atmosphere,Room Temperature | [pka]
-2.24±0.20(Predicted) | [InChI]
InChI=1S/C12H11NO3/c1-8(14)6-7-13-11(15)9-4-2-3-5-10(9)12(13)16/h2-5H,6-7H2,1H3 | [InChIKey]
ONTXCMXICQNNNO-UHFFFAOYSA-N | [SMILES]
C1(=O)C2=C(C=CC=C2)C(=O)N1CCC(=O)C |
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