1H-Benzimidazole,1-(difluoromethyl)-2-methyl- supplier

Name
1H-Benzimidazole,1-(difluoromethyl)-2-methyl-(9CI)
EINECS
CAS No. 84941-16-2
Article Data8
CAS DataBase
Density 1.29 g/cm³
Solubility
Melting Point
Formula C₉H₈F₂N₂
Boiling Point 269.1 °C at 760 mmHg
Molecular Weight 182.17
Flash Point 116.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(Difluoromethyl)-2-methyl-1H-benzimidazole;1-(Difluoromethyl)-2-methylbenzimidazole;
PSA 17.82000
LogP 2.73980

1H-Benzimidazole,1-(difluoromethyl)-2-methyl- Specification

The 1H-Benzimidazole,1-(difluoromethyl)-2-methyl-, with the CAS registry number 84941-16-2, is also known as 1-(Difluoromethyl)-2-methyl-1H-benzimidazole. It belongs to the product category of Benzimidazole. This chemical's molecular formula is C₉H₈F₂N₂ and molecular weight is 182.17. What's more, its IUPAC name is 1-(difluoromethyl)-2-methylbenzimidazole.

Physical properties of 1H-Benzimidazole,1-(difluoromethyl)-2-methyl- are: (1)ACD/LogP: 2.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.35; (4)ACD/LogD (pH 7.4): 2.49; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 17.82 Å²; (9)Index of Refraction: 1.559; (10)Molar Refractivity: 45.48 cm³; (11)Molar Volume: 140.8 cm³; (12)Polarizability: 18.03×10^-24cm³; (13)Surface Tension: 33.5 dyne/cm; (14)Density: 1.29 g/cm³; (15)Flash Point: 116.5 °C; (16)Enthalpy of Vaporization: 48.68 kJ/mol; (17)Boiling Point: 269.1 °C at 760 mmHg; (18)Vapour Pressure: 0.0123 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=NC2=CC=CC=C2N1C(F)F
(2)InChI: InChI=1S/C9H8F2N2/c1-6-12-7-4-2-3-5-8(7)13(6)9(10)11/h2-5,9H,1H3
(3)InChIKey: AJRUWLNEYCWDTC-UHFFFAOYSA-N

Product Name

1H-Benzimidazole,1-(difluoromethyl)-2-methyl-(9CI)

1H-Benzimidazole,1-(difluoromethyl)-2-methyl- Specification

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