CAS 939-83-3|2-Methyl-5-nitrobenzonitrile
Introduction：Basic information about CAS 939-83-3|2-Methyl-5-nitrobenzonitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-Methyl-5-nitrobenzonitrile | ||
|---|---|---|---|
| CAS Number | 939-83-3 | Molecular Weight | 162.145 |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 291.5±28.0 °C at 760 mmHg |
| Molecular Formula | C8H6N2O2 | Melting Point | 103.5-107.5 °C(lit.) |
| MSDS | USA | Flash Point | 130.1±24.0 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | 2-Methyl-5-nitrobenzonitrile |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 291.5±28.0 °C at 760 mmHg |
| Melting Point | 103.5-107.5 °C(lit.) |
| Molecular Formula | C8H6N2O2 |
| Molecular Weight | 162.145 |
| Flash Point | 130.1±24.0 °C |
| Exact Mass | 162.042923 |
| PSA | 69.61000 |
| LogP | 1.63 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.568 |
| InChIKey | XOSDYLFXPMFRGF-UHFFFAOYSA-N |
| SMILES | Cc1ccc([N+](=O)[O-])cc1C#N |
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | R20/21/22 |
| Safety Phrases | S26-S36 |
| RIDADR | 3276 |
| WGK Germany | 3 |
| Packaging Group | III |
| Hazard Class | 6.1 |
| HS Code | 2926909090 |
Customs
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
Articles3
More Articles| 2-Methyl-5-nitro-benzonitrile. Acta Crystallogr. Sect. E Struct. Rep. Online 64(6) , o972, (2008) In the title compound, C(8)H(6)N(2)O(2), the nitro group is rotated by 10.2 (2)° out of the plane of the benzene ring. The crystal structure is stabilized by van der Waals inter-actions. | |
| 5-(2-Methyl-5-nitro-phen-yl)-1H-tetra-zole. Acta Crystallogr. Sect. E Struct. Rep. Online 64(10) , o1944, (2008) In the title compound, C(8)H(7)N(5)O(2), the benzene ring makes a dihedral angle of 45.7 (2)° with the tetra-zole ring. In the crystal structure, the mol-ecules are linked into a chain running along t... | |
| Recent aspects of nitration: New preparative methods and mechanistic studies (A Review). Olah GA, et al. Proc. Natl. Acad. Sci. U. S. A. 79(14) , 4487-94, (1982) |
Synonyms
| 5-Nitro-ortho-tolunitrile |
| Benzonitrile, 2-methyl-5-nitro- |
| 2-Methyl-5-nitrobenzonitrile |
| MFCD00017040 |
