| Identification | Back Directory | [Name]
4-IODOPHTHALONITRILE 97 | [CAS]
69518-17-8 | [Synonyms]
4-Iodophthalonitri
4-IODOPHTHALONITRILE 97
4-Iodophthalonitrile 97%
1,2-Dicyano-4-iodobenzene
1,2-Benzenedicarbonitrile, 4-iodo- | [Molecular Formula]
C8H3IN2 | [MDL Number]
MFCD01863730 | [MOL File]
69518-17-8.mol | [Molecular Weight]
254.026 |
| Chemical Properties | Back Directory | [Melting point ]
140-142 °C(lit.)
| [Boiling point ]
364.7±37.0 °C(Predicted) | [density ]
1.95±0.1 g/cm3(Predicted) | [storage temp. ]
Keep in dark place,Sealed in dry,Room Temperature | [form ]
powder to crystaline | [color ]
Light yellow to Brown | [InChI]
1S/C8H3IN2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3H | [InChIKey]
OOHQHYJZUSXMFD-UHFFFAOYSA-N | [SMILES]
Ic1ccc(C#N)c(c1)C#N |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
20/21/22-36/37/38 | [Safety Statements ]
26-36 | [WGK Germany ]
3
| [HS Code ]
2926.90.4801 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Synthesis]
1.6 g (0.011 mol) 4-aminophthalonitrile was dissolved in 22.4 mL of 2.5 M
H2SO4. The mixture was cooled to 0 ??C. To the solution was slowly added 0.9 g
(0.013 mol) of NaNO2 dissolved in 3.5 mL of water. After the mixture was stirred for
30 minutes, 2.08 g (0.013 mol) of KI dissolved in 12.8 mL of water was added. The
mixture was further stirred for 45 minutes at room temperature. After this period, the
brown solid was filtered and washed with water. It was dissolved in a minimal
amount of chloroform. The solution was washed first with saturated Na2S2O3 and
then with water. It was dried over Na2SO4. After the solution was filtered, it was
dried in vacuum and purified with column chromatography over silica gel by eluting
with dichloromethane. Molecular formula: IC6H3-1,2-(CN)2 (254.03 g/mol). Yield:
2.37 g (85%).
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Energy Chemical
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