| Identification | More | [Name]
4-(METHYLSULFONYL)BENZONITRILE | [CAS]
22821-76-7 | [Synonyms]
4-METHANESULFONYL-BENZONITRILE
4-(METHYLSULFONYL)BENZONITRILE
4-METHYLSULPHONYL BENZONITRILE
BUTTPARK 121\04-70
Benzonitrile, 4-(methylsulfonyl)-
Benzonitrile, p-(methylsulfonyl)-
p-Methanesulfonylbenzonitrile
4-(Methylsulphonyl)benzonitrile 98% | [Molecular Formula]
C8H7NO2S | [MDL Number]
MFCD00216489 | [Molecular Weight]
181.21 | [MOL File]
22821-76-7.mol |
| Chemical Properties | Back Directory | [Appearance]
white to brown crystalline powder | [Melting point ]
137-142 °C | [Boiling point ]
385.8±34.0 °C(Predicted) | [density ]
1.3055 (rough estimate) | [refractive index ]
1.5650 (estimate) | [storage temp. ]
Sealed in dry,Room Temperature | [form ]
Crystalline Powder | [color ]
White to orange to brown | [InChI]
1S/C8H7NO2S/c1-12(10,11)8-4-2-7(6-9)3-5-8/h2-5H,1H3 | [InChIKey]
FARXIDYHJAANGP-UHFFFAOYSA-N | [SMILES]
CS(=O)(=O)c1ccc(cc1)C#N | [CAS DataBase Reference]
22821-76-7(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn,Xi | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed . | [Safety Statements ]
S24/25:Avoid contact with skin and eyes . | [WGK Germany ]
WGK 3 | [Hazard Note ]
Irritant | [HS Code ]
29214200 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral |
| Hazard Information | Back Directory | [Chemical Properties]
white to brown crystalline powder | [Definition]
ChEBI: 4-(Methylsulfonyl)benzonitrile is a sulfonic acid derivative. |
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