Methyl 3-nitrobenzoate
- Product NameMethyl 3-nitrobenzoate
- CAS618-95-1
- CBNumberCB9778023
- MFC8H7NO4
- MW181.15
- EINECS210-573-0
- MDL NumberMFCD00007250
- MOL File618-95-1.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 78-80 °C (lit.) |
| Boiling point | 279 °C (lit.) |
| Density | 1.4283 (rough estimate) |
| refractive index | 1.5468 (estimate) |
| Flash point | 279°C |
| storage temp. | Sealed in dry,Room Temperature |
| form | Crystalline Powder |
| color | Beige |
| Water Solubility | insoluble |
| BRN | 392449 |
| Stability | Stable. Incompatible with strong oxidizing agents. |
| InChI | 1S/C8H7NO4/c1-13-8(10)6-3-2-4-7(5-6)9(11)12/h2-5H,1H3 |
| InChIKey | AXLYJLKKPUICKV-UHFFFAOYSA-N |
| SMILES | COC(=O)c1cccc(c1)[N+]([O-])=O |
| CAS DataBase Reference | 618-95-1(CAS DataBase Reference) |
| FDA UNII | UWP97MS7EU |
| NIST Chemistry Reference | 3-O2N-C6H4-COOCH3(618-95-1) |
| EPA Substance Registry System | Benzoic acid, 3-nitro-, methyl ester (618-95-1) |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H302-H315-H319-H335 | |||||||||
| Precautionary statements | P261-P305+P351+P338 | |||||||||
| Safety Statements | 24/25 | |||||||||
| WGK Germany | 3 | |||||||||
| TSCA | TSCA listed | |||||||||
| HS Code | 29163900 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| NFPA 704: |
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