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Cas Database |
| Name |
5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole |
EINECS | N/A |
| CAS No. | 99686-99-4 | Density | 1.25g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C11H11N3O2 | Boiling Point | 407.5°C at 760 mmHg |
| Molecular Weight | 217.227 | Flash Point | 200.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Mutation data reported. When heated to decomposition it emits toxic vapors of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
Article Data | 3 |
5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole Chemical Properties
IUPAC Name: 1-Benzyl-5-methyl-4-nitroimidazole
Following is the structure of 5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole (CAS NO.99686-99-4):
Empirical Formula: C11H11N3O2
Molecular Weight: 217.2239 g/mol
Surface Tension: 50.9 dyne/cm
Density: 1.25 g/cm3
Flash Point: 200.2 °C
Enthalpy of Vaporization: 63.37 kJ/mol
Boiling Point: 407.5 °C at 760 mmHg
Vapour Pressure: 1.77E-06 mmHg at 25 °C
Index of Refraction of 5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole (CAS NO.99686-99-4): 1.619
Canonical SMILES: CC1=C(N=CN1CC2=CC=CC=C2)[N+](=O)[O-]
InChI: InChI=1S/C11H11N3O2/c1-9-11(14(15)16)12-8-13(9)7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3
InChIKey: IVOFFUJFQWPQKN-UHFFFAOYSA-N
5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole Toxicity Data With Reference
| 1. | mic-sat 602 pmol/plate | MUREAV Mutation Research. 397 (1998),293. |
5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole Safety Profile
Mutation data reported. When heated to decomposition, 5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole (CAS NO.99686-99-4) emits toxic vapors of NOx.
5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole Specification
5-Methyl-4-nitro-1-(phenylmethyl)-1H-imidazole , its cas register number is 99686-99-4. It also can be called 1H-Imidazole, 5-methyl-4-nitro-1-(phenylmethyl)- . Its classification code is Mutation data.
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