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51437-32-2

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Basic Information
CAS No.: 51437-32-2
Name: 2-METHYL-5,6-DIMETHOXYBENZIMIDAZOLE
Article Data: 3
Molecular Structure:
Molecular Structure of 51437-32-2 (2-METHYL-5,6-DIMETHOXYBENZIMIDAZOLE)
Formula: C10H12N2O2
Molecular Weight: 192.217
Synonyms: Benzimidazole,5,6-dimethoxy-2-methyl- (6CI);5,6-dimethoxy-2-methyl-1H-benzimidazole;1H-benzimidazole, 5,6-dimethoxy-2-methyl-;
Density: 1.206 g/cm3
Boiling Point: 390.5 °C at 760 mmHg
Flash Point: 141.8 °C
PSA: 47.14000
LogP: 1.88850
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Specification

The 1H-Benzimidazole,5,6-dimethoxy-2-methyl-, with the CAS registry number 51437-32-2, has the systematic name of 5,6-dimethoxy-2-methyl-1H-benzimidazole. It belongs to the following product categories: Benzimidazole; Imidazol & Benzimidazole. And the molecular formula of the chemical is C10H12N2O2.

The characteristics of 1H-Benzimidazole,5,6-dimethoxy-2-methyl- are as followings: (1)ACD/LogP: 2.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.88; (4)ACD/LogD (pH 7.4): 2.3; (5)ACD/BCF (pH 5.5): 12.38; (6)ACD/BCF (pH 7.4): 32.92; (7)ACD/KOC (pH 5.5): 158.59; (8)ACD/KOC (pH 7.4): 421.88; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 36.28 Å2; (13)Index of Refraction: 1.603; (14)Molar Refractivity: 54.8 cm3; (15)Molar Volume: 159.3 cm3; (16)Polarizability: 21.72×10-24cm3; (17)Surface Tension: 46.3 dyne/cm; (18)Density: 1.206 g/cm3; (19)Flash Point: 141.8 °C; (20)Enthalpy of Vaporization: 61.5 kJ/mol; (21)Boiling Point: 390.5 °C at 760 mmHg; (22)Vapour Pressure: 5.94E-06 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(c2cc1c(nc(n1)C)cc2OC)C
(2)InChI: InChI=1/C10H12N2O2/c1-6-11-7-4-9(13-2)10(14-3)5-8(7)12-6/h4-5H,1-3H3,(H,11,12)
(3)InChIKey: UZXACZRAUVKJFI-UHFFFAOYAY