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| CAS No.: | 850429-59-3 |
|---|---|
| Name: | 4-BROMO-1,2-DIMETHYL-1H-IMIDAZOLE |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C5H7BrN2 |
| Molecular Weight: | 175.028 |
| Synonyms: | 4-Bromo-1,2-dimethyl-1H-imidazole; |
| Density: | 1.58 g/cm3 |
| Melting Point: | 40-44 °C |
| Boiling Point: | 266.6 °C at 760 mmHg |
| Flash Point: | 115 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 22 |
| PSA: | 17.82000 |
| LogP: | 1.49100 |
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- Total:21 Page 1 of 1 1
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Specification
The 1H-Imidazole,4-bromo-1,2-dimethyl-, with the CAS registry number 850429-59-3, is also known as 4-Bromo-1,2-dimethyl-1H-imidazole. It belongs to the product categories of Blocks; Bromides; Imidazoles. This chemical's molecular formula is C5H7BrN2 and molecular weight is 175.03. What's more, its IUPAC name is called 4-Bromo-1,2-dimethylimidazole. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about 1H-Imidazole,4-bromo-1,2-dimethyl- are: (1) ACD/LogP: 0.42; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 2; (4) #H bond donors: 0; (5) #Freely Rotating Bonds: 0; (6) Polar Surface Area: 17.82 Å2; (7) Index of Refraction: 1.589; (8) Molar Refractivity: 37.23 cm3; (9) Molar Volume: 110.4 cm3; (10) Surface Tension: 38.3 dyne/cm; (11) Density: 1.58 g/cm3; (12) Flash Point: 115 °C; (13) Enthalpy of Vaporization: 48.43 kJ/mol; (14) Boiling Point: 266.6 °C at 760 mmHg; (15) Vapour Pressure: 0.0141 mmHg at 25 °C; (16) Melting Point: 40-44 °C.
You can still convert the following datas into molecular structure:
SMILES: Brc1nc(n(c1)C)C
(2) InChI: InChI=1/C5H7BrN2/c1-4-7-5(6)3-8(4)2/h3H,1-2H3
(3) InChIKey: FZRKTLGQQTWOMJ-UHFFFAOYAG