3-Nitro-N-(3-Nitrophenyl)Benzamide
Product Description
| Product | 3-Nitro-N-(3-Nitrophenyl)Benzamide |
| CAS | 101-24-6 |
| Formula | C13H9N3O5 |
| Synonym | 3-Nitro-N-(3-nitrophenyl)benzamide, 3,3'-dinitrobenzanilide, 3,3'-Dinitrobenzanilide, EINECS 202-927-8, NSC 9593, 3,3'-Dinitrobenzanilide, Benzamide, 3-nitro-N-(3-nitrophenyl)-, Benzanilide, 3,3'-dinitro- (8CI) |
Typical Product Specifications
| InChIKey | 1S/C13H9N3O5/c17-13(9-3-1-5-11(7-9)15(18)19)14-10-4-2-6-12(8-10)16(20)21/h1-8H,(H,14,17) |
| Molecular weight | 258.10 |
| EINECS | 202-930-4 |
| SMILES | c1(cc(ccc1)Cl)NC(OCC#CCCl)=O |
| InChI | 1S/C11H9Cl2NO2/c12-6-1-2-7-16-11(15)14-10-5-3-4-9(13)8-10/h3-5,8H,6-7H2,(H,14,15) |
| InChIKey | MCOQHIWZJUDQIC-UHFFFAOYSA-N |
| Boiling Point | 224 dec ° C |
| Atmospheric OH Rate Constant | 5.54E-11 cm3/molecule-sec |
| Henry's Law Constant | 1.17E-08 atm-m3/mole |
| Vapor Pressure | 3.80E-07 mm Hg |
| Melting Point | 75 ° C |
| log P (octanol-water) | 3.410 |
| Water solubility | 11 mg/L |
| Molecular weight | 287.23 |
| EINECS | 202-927-8 |
| SMILES | O=C(Nc1cccc([N+]([O-])=O)c1)c1cccc([N+]([O-])=O)c1 |
| InChI | IGYJMXLXTJJVRS-UHFFFAOYSA-N |
| Class | Specialty Chemicals |
| Industry | Agricultural |
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