ChemicalBook--->CAS DataBase List--->3783-77-5

3783-77-5

3783-77-5 Structure

3783-77-5 Structure
IdentificationBack 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 PropertiesBack 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)
[Appearance]

White to light yellow Solid
[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
Safety DataBack Directory
[HS Code ]

2925199590
Spectrum DetailBack Directory
[Spectrum Detail]

2-(3-oxobutyl)isoindoline-1,3-dione(3783-77-5)1HNMR
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