1H-Benzimidazole,5-chloro-1,6-dimethyl- supplier

Name
1H-Benzimidazole,5-chloro-1,6-dimethyl-(9CI)
EINECS
CAS No. 81449-99-2
Article Data3
CAS DataBase
Density 1.25 g/cm³
Solubility
Melting Point
Formula C₉H₉ClN₂
Boiling Point 310.6 °C at 760 mmHg
Molecular Weight 180.637
Flash Point 141.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzimidazole, 5-chloro-1,6-dimethyl- (2CI);NSC 240561;5-Chloro-1,6-dimethylbenzimidazole;5-Chloro-1,6-dimethyl-1H-benzimidazole;
PSA 17.82000
LogP 2.53510

1H-Benzimidazole,5-chloro-1,6-dimethyl- Specification

The 1H-Benzimidazole,5-chloro-1,6-dimethyl-, with the CAS registry number 81449-99-2, is also known as 5-chloro-1,6-dimethyl-1H-benzimidazole. It belongs to the product category of Benzimidazole. This chemical's molecular formula is C₉H₉ClN₂ and molecular weight is 180.63. What's more, its systematic name is 5-chloro-1,6-dimethylbenzimidazole.

Physical properties of 1H-Benzimidazole,5-chloro-1,6-dimethyl- are: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 17.82 Å²; (7)Index of Refraction: 1.616; (8)Molar Refractivity: 50.16 cm³; (9)Molar Volume: 143.4 cm³; (10)Polarizability: 19.88×10^-24cm³; (11)Surface Tension: 39.6 dyne/cm; (12)Density: 1.25 g/cm³; (13)Flash Point: 141.6 °C; (14)Enthalpy of Vaporization: 55.14 kJ/mol; (15)Boiling Point: 310.6 °C at 760 mmHg; (16)Vapour Pressure: 0.000594 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC2=C(C=C1Cl)N=CN2C
(2)InChI: InChI=1S/C9H9ClN2/c1-6-3-9-8(4-7(6)10)11-5-12(9)2/h3-5H,1-2H3
(3)InChIKey: ZEYPSQGLVLOLLD-UHFFFAOYSA-N

Product Name

1H-Benzimidazole,5-chloro-1,6-dimethyl-(9CI)

1H-Benzimidazole,5-chloro-1,6-dimethyl- Specification

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