| Identification | Back Directory | [Name]
5-NITROISOINDOLIN-1-ONE | [CAS]
876343-38-3 | [Synonyms]
5-NITROISOINDOLIN-1-ONE
5-Nitro-2,3-dihydroisoindol-1-one
5-Nitro-2,3-dihydro-1H-isoindol-1-one
1H-Isoindol-1-one, 2,3-dihydro-5-nitro- | [Molecular Formula]
C8H6N2O3 | [MDL Number]
MFCD10000827 | [MOL File]
876343-38-3.mol | [Molecular Weight]
178.15 |
| Chemical Properties | Back Directory | [Boiling point ]
505.8±50.0 °C(Predicted) | [density ]
1.449±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [pka]
12.36±0.20(Predicted) | [Appearance]
Off-white to brown Solid | [InChI]
InChI=1S/C8H6N2O3/c11-8-7-2-1-6(10(12)13)3-5(7)4-9-8/h1-3H,4H2,(H,9,11) | [InChIKey]
CZXUANYPXDFFOG-UHFFFAOYSA-N | [SMILES]
C1(=O)C2=C(C=C([N+]([O-])=O)C=C2)CN1 |
| Hazard Information | Back Directory | [Synthesis]
5-Nitroisoindolin-1-one can be obtained from 2-methyl-4-nitrobenzoic acid by esterifying 2-methyl-4-nitrobenzoic acid, then brominating to obtain 2-(bromomethyl)-4-nitrobenzoic acid methyl ester, and finally ring-closing. |
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