The 1H-Imidazole,1,2-dimethyl-5-nitro-, hydrochloride (1:1) is an organic compound with the formula C5H8ClN3O2. The IUPAC name of this chemical is 1,2-dimethyl-5-nitroimidazole hydrochloride. With the CAS registry number 25332-20-1, it is also named as 1H-Imidazole, 1,2-dimethyl-5-nitro-, monohydrochloride.
Physical properties about 1H-Imidazole,1,2-dimethyl-5-nitro-, hydrochloride (1:1) are: (1)ACD/LogP: 0.31; (2)ACD/LogD (pH 5.5): 0.31; (3)ACD/LogD (pH 7.4): 0.31; (4)ACD/BCF (pH 5.5): 1.01; (5)ACD/BCF (pH 7.4): 1.01; (6)ACD/KOC (pH 5.5): 34.91; (7)ACD/KOC (pH 7.4): 34.98; (8)#H bond acceptors: 5; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 63.64 Å2; (11)Flash Point: 143.5 °C; (12)Enthalpy of Vaporization: 53.27 kJ/mol; (13)Boiling Point: 313.7 °C at 760 mmHg; (14)Vapour Pressure: 0.000901 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1cnc(n1C)C.Cl
(2)InChI: InChI=1/C5H7N3O2.ClH/c1-4-6-3-5(7(4)2)8(9)10;/h3H,1-2H3;1H
(3)InChIKey: UBQLFSIVOXQYEL-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C5H7N3O2.ClH/c1-4-6-3-5(7(4)2)8(9)10;/h3H,1-2H3;1H
(5)Std. InChIKey: UBQLFSIVOXQYEL-UHFFFAOYSA-N
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View