Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
1H-Benzimidazole,6-iodo- |
EINECS | N/A |
CAS No. | 78597-27-0 | Density | 2.082 g/cm3 |
PSA | 28.68000 | LogP | 2.16750 |
Solubility | N/A | Melting Point |
144-145 °C |
Formula | C7H5IN2 | Boiling Point | 438.5 °C at 760 mmHg |
Molecular Weight | 244.035 | Flash Point | 219 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
5-Iodobenzimidazole;5-Iodo-1H-benzimidazole;Benzimidazole, 5(or 6)-iodo- (7CI);1H-Benzimidazole,5-iodo- (9CI); |
Article Data | 2 |
The 1H-Benzimidazole,6-iodo- is an organic compound with the formula C7H5IN2. The systematic name of this chemical is 6-iodo-1H-benzimidazole. With the CAS registry number 78597-27-0, it is also named as 5-Iodobenzimidazole.
Physical properties about 1H-Benzimidazole,6-iodo- are: (1)ACD/LogP: 2.57; (2)ACD/LogD (pH 5.5): 2.5; (3)ACD/LogD (pH 7.4): 2.56; (4)ACD/BCF (pH 5.5): 44.78; (5)ACD/BCF (pH 7.4): 52.27; (6)ACD/KOC (pH 5.5): 505.99; (7)ACD/KOC (pH 7.4): 590.53; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Polar Surface Area: 28.68 Å2; (11)Index of Refraction: 1.787; (12)Molar Refractivity: 49.52 cm3; (13)Molar Volume: 117.1 cm3; (14)Polarizability: 19.63×10-24cm3; (15)Surface Tension: 71.2 dyne/cm; (16)Density: 2.082 g/cm3; (17)Flash Point: 219 °C; (18)Enthalpy of Vaporization: 66.84 kJ/mol; (19)Boiling Point: 438.5 °C at 760 mmHg; (20)Vapour Pressure: 1.77E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Ic1ccc2ncnc2c1
(2)InChI: InChI=1/C7H5IN2/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H,(H,9,10)
(3)InChIKey: NQDPBRYGCUYBJM-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C7H5IN2/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H,(H,9,10)
(5)Std. InChIKey: NQDPBRYGCUYBJM-UHFFFAOYSA-N