1H-Benzimidazol-2-amine,6-chloro-5-fluoro- supplier

Name
1H-Benzimidazol-2-amine,5-chloro-6-fluoro-(9CI)
EINECS
CAS No. 142356-64-7
Article Data1
CAS DataBase
Density 1.634 g/cm³
Solubility
Melting Point
Formula C₇H₅ClFN₃
Boiling Point 408.6 °C at 760 mmHg
Molecular Weight 185.588
Flash Point 200.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1H-Benzimidazol-2-amine,5-chloro-6-fluoro- (9CI);2-Amino-5(6)-chloro-6(5)-fluorobenzimidazole;5-Chloro-6-fluoro-1H-benzimidazol-2-amine;2-Amino-5-chloro-6-fluorobenzimidazole;
PSA 54.70000
LogP 2.51880

1H-Benzimidazol-2-amine,6-chloro-5-fluoro- Specification

The 1H-Benzimidazol-2-amine,6-chloro-5-fluoro-, with the CAS registry number 142356-64-7, is also known as 2-Amino-5-chloro-6-fluorobenzimidazole. It belongs to the product category of Benzimidazole. This chemical's molecular formula is C₇H₅ClFN₃ and molecular weight is 185.59. What's more, its systematic name is 5-chloro-6-fluoro-1H-benzimidazol-2-amine.

Physical properties of 1H-Benzimidazol-2-amine,6-chloro-5-fluoro- are: (1)ACD/LogP: 2.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.85; (4)ACD/LogD (pH 7.4): 2.02; (5)ACD/BCF (pH 5.5): 13.57; (6)ACD/BCF (pH 7.4): 20.11; (7)ACD/KOC (pH 5.5): 199.45; (8)ACD/KOC (pH 7.4): 295.59; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 54.7 Å²; (13)Index of Refraction: 1.739; (14)Molar Refractivity: 45.74 cm³; (15)Molar Volume: 113.5 cm³; (16)Polarizability: 18.13×10^-24cm³; (17)Surface Tension: 74.6 dyne/cm; (18)Density: 1.634 g/cm³; (19)Flash Point: 200.9 °C; (20)Enthalpy of Vaporization: 66.07 kJ/mol; (21)Boiling Point: 408.6 °C at 760 mmHg; (22)Vapour Pressure: 6.9E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc2nc(N)nc2cc1Cl
(2)InChI: InChI=1S/C7H5ClFN3/c8-3-1-5-6(2-4(3)9)12-7(10)11-5/h1-2H,(H3,10,11,12)
(3)InChIKey: BLXGHUSEUDLUBK-UHFFFAOYSA-N

Product Name

1H-Benzimidazol-2-amine,5-chloro-6-fluoro-(9CI)

1H-Benzimidazol-2-amine,6-chloro-5-fluoro- Specification

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