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Cas Database |
| Name |
4,5-Dimethyl-1H-imidazole hydrochloride |
EINECS | N/A |
| CAS No. | 53316-51-1 | Density | N/A |
| PSA | 28.68000 | LogP | 1.82850 |
| Solubility | N/A | Melting Point |
305 °C (decomp)(Solv: water (7732-18-5)) |
| Formula | C5H9ClN2 | Boiling Point | 305.9 °C at 760 mmHg |
| Molecular Weight | 132.59 | Flash Point | 138.8 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1H-Imidazole,4,5-dimethyl-, monohydrochloride (9CI);4,5-Dimethylimidazole hydrochloride; |
Article Data | 3 |
4,5-Dimethyl-1H-imidazole hydrochloride Specification
This chemical is called 4,5-Dimethyl-1H-imidazole hydrochloride, and it can also be named as 4,5-Dimethylimidazole HCl. With the molecular formula of C5H9ClN2, its molecular weight is 132.59. The CAS registry number of this chemical is 53316-51-1.
Other characteristics of the 4,5-Dimethyl-1H-imidazole hydrochloride can be summarised as followings: (1)ACD/LogP: 0.76; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 28.68 Å2; (7)Flash Point: 138.8 °C; (8)Enthalpy of Vaporization: 55.73 kJ/mol; (9)Boiling Point: 305.9 °C at 760 mmHg; (10)Vapour Pressure: 0.000592 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Cl.Cc1ncnc1C
2.InChI: InChI=1/C5H8N2.ClH/c1-4-5(2)7-3-6-4;/h3H,1-2H3,(H,6,7);1H
3.InChIKey: RKSANQPKBITNSO-UHFFFAOYAD
4.Std. InChI: InChI=1S/C5H8N2.ClH/c1-4-5(2)7-3-6-4;/h3H,1-2H3,(H,6,7);1H
5.Std. InChIKey: RKSANQPKBITNSO-UHFFFAOYSA-N
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