CAS No.25332-20-1,1,2-dimethyl-5-nitro-1H-imidazole monohydrochloride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	25332-20-1
Name:	1,2-dimethyl-5-nitro-1H-imidazole monohydrochloride

Formula:	C₅H₈ClN₃O₂
Molecular Weight:	246-853-4
Synonyms:	1H-Imidazole,1,2-dimethyl-5-nitro-, monohydrochloride (9CI);Imidazole,1,2-dimethyl-5-nitro-, monohydrochloride (8CI);Dimetridazole hydrochloride;
EINECS:	246-853-4
Boiling Point:	313.7 °C at 760 mmHg
Flash Point:	143.5 °C
PSA:	63.64000
LogP:	1.96190

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Specification

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