| Identification | More | [Name]
3-Nitrophthalonitrile | [CAS]
51762-67-5 | [Synonyms]
1,2-DICYANO-3-NITROBENZENE
2,3-DICYANONITROBENZENE
3-NITRO-PHTHALODINITRILE
3-NITROPHTHALONITRILE
3-nitro-1,2-benzenedicarbonitrile
3-nitro-2-benzenedicarbonitrile
2,3-Dicyano-1-nitrobenzene
Nitrophthalonitrile
3-NITROPHTHALONITRILE 98+%
3-Nitro-1,2-dicyanobenzene
3-Nitrobenzene-1,2-dicarbonitrile | [EINECS(EC#)]
-0 | [Molecular Formula]
C8H3N3O2 | [MDL Number]
MFCD00191558 | [Molecular Weight]
173.13 | [MOL File]
51762-67-5.mol |
| Chemical Properties | Back Directory | [Appearance]
light yellow powder | [Melting point ]
162-165 °C (lit.) | [Boiling point ]
386.1±37.0 °C(Predicted) | [density ]
1.41±0.1 g/cm3(Predicted) | [vapor pressure ]
0Pa at 20-25℃ | [storage temp. ]
room temp | [form ]
Powder | [color ]
White to Light yellow to Green | [Water Solubility ]
Soluble in methanol. Insoluble in water. | [BRN ]
2263686 | [LogP]
0.3 at 25℃ | [Surface tension]
70.3mN/m at 212.5mg/L and 25℃ | [CAS DataBase Reference]
51762-67-5(CAS DataBase Reference) | [EPA Substance Registry System]
51762-67-5(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S37/39:Wear suitable gloves and eye/face protection . | [WGK Germany ]
3
| [RTECS ]
CZ1953200
| [HS Code ]
29269090 |
| Hazard Information | Back Directory | [Chemical Properties]
light yellow powder | [Uses]
3-Nitrophthalonitrile can be used in solar cells. Dyes and metabolites. | [Application]
3-Nitrophthalonitrile belongs to nitrile derivatives and can be used as pesticide and pharmaceutical intermediates. It is an important intermediate for the synthesis of nitrophthalocyanine, nitrometallophthalocyanine or other phthalocyanine derivatives. | [Preparation]
The synthesis of 3-nitrophthalonitrile started with the nitration in position 3 of phthalimide followed by the formation of 3-nitrophthalamide; then dehydration by the thionyl chloride in N, N-dimethylformamide leads to 3-nitrophthalonitrile.
Synthesis of 3-Nitrophthalonitrile | [Synthesis Reference(s)]
Journal of Heterocyclic Chemistry, 32, p. 495, 1995 DOI: 10.1002/jhet.5570320219 |
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