1H-Benzimidazole,6-iodo- supplier

Name
5-IODO-1H-BENZIMIDAZOLE
EINECS
CAS No. 78597-27-0
Article Data2
CAS DataBase
Density 2.082 g/cm³
Solubility
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
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Iodobenzimidazole;5-Iodo-1H-benzimidazole;Benzimidazole, 5(or 6)-iodo- (7CI);1H-Benzimidazole,5-iodo- (9CI);
PSA 28.68000
LogP 2.16750

1H-Benzimidazole,6-iodo- Specification

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

Product Name

5-IODO-1H-BENZIMIDAZOLE

1H-Benzimidazole,6-iodo- Specification

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