Products Categories
CAS No.: | 4404-32-4 |
---|---|
Name: | (1Z)-2-(1H-BENZIMIDAZOL-2-YL)-N'-HYDROXYETHANIMIDAMIDE |
Molecular Structure: | |
Formula: | C9H10N4O |
Molecular Weight: | 190.205 |
Synonyms: | 2-Benzimidazoleacetamidoxime(7CI,8CI); |
Density: | 1.47 g/cm3 |
Boiling Point: | 538.2 °C at 760 mmHg |
Flash Point: | 279.3 °C |
PSA: | 84.79000 |
LogP: | 1.55210 |
What can I do for you?
Get Best Price
The 1H-Benzimidazole-2-ethanimidamide, N-hydroxy-, with the CAS registry number of 4404-32-4, is also known as 1H-Benzimidazole-2-ethanimidamide, N-hydroxy- (9CI). It belongs to the product category of Benzimidazole. This chemical's molecular formula is C9H10N4O and molecular weight is 190.2019. What's more, its systematic name is called 2-(1H-Benzimidazol-2-yl)-N'-hydroxyethanimidamide.
Physical properties about 1H-Benzimidazole-2-ethanimidamide, N-hydroxy- are: (1)ACD/LogP: 0.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.02; (4)ACD/LogD (pH 7.4): 0.76; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 2.17; (7)ACD/KOC (pH 5.5): 9.88; (8)ACD/KOC (pH 7.4): 59.55; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 42.65 Å2; (13)Index of Refraction: 1.72; (14)Molar Refractivity: 50.85 cm3; (15)Molar Volume: 128.6 cm3; (16)Surface Tension: 64.3 dyne/cm; (17)Density: 1.47 g/cm3; (18)Flash Point: 279.3 °C; (19)Enthalpy of Vaporization: 85.82 kJ/mol; (20)Boiling Point: 538.2 °C at 760 mmHg; (21)Vapour Pressure: 2.04E-12 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: ON=C(N)Cc2nc1ccccc1n2
(2) InChI: InChI=1/C9H10N4O/c10-8(13-14)5-9-11-6-3-1-2-4-7(6)12-9/h1-4,14H,5H2,(H2,10,13)(H,11,12)
(3) InChIKey: WKGKAABDZKCWKQ-UHFFFAOYAM