1H-Benzimidazole,2-(3-furanyl)- supplier

Name
1H-Benzimidazole,2-(3-furanyl)-(9CI)
EINECS
CAS No. 3878-22-6
Article Data6
CAS DataBase
Density 1.286 g/cm³
Solubility
Melting Point 305-307 °C
Formula C₁₁H₈N₂O
Boiling Point 382.3 °C at 760 mmHg
Molecular Weight 184.197
Flash Point 195.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzimidazole,2-(3-furyl)- (7CI,8CI);2-(4-Furyl)benzimidazole;2-(Furan-3-yl)-1H-benzimidazole;NSC 283172;2-(Furan-3-yl)-1H-1,3-benzodiazole;
PSA 41.82000
LogP 2.82290

1H-Benzimidazole,2-(3-furanyl)- Specification

The 1H-Benzimidazole,2-(3-furanyl)-, with the CAS registry number 3878-22-6, is also known as 2-(Furan-3-yl)-1H-1,3-benzodiazole. It belongs to the product category of Benzimidazole. This chemical's molecular formula is C₁₁H₈N₂O and molecular weight is 184.19. What's more, its systematic name is 2-(furan-3-yl)-1H-benzimidazole.

Physical properties of 1H-Benzimidazole,2-(3-furanyl)- are: (1)ACD/LogP: 2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.18; (4)ACD/LogD (pH 7.4): 2.4; (5)ACD/BCF (pH 5.5): 23.72; (6)ACD/BCF (pH 7.4): 39.46; (7)ACD/KOC (pH 5.5): 289.73; (8)ACD/KOC (pH 7.4): 482.06; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 30.96 Å²; (13)Index of Refraction: 1.67; (14)Molar Refractivity: 53.51 cm³; (15)Molar Volume: 143.1 cm³; (16)Polarizability: 21.21×10^-24cm³; (17)Surface Tension: 56.3 dyne/cm; (18)Density: 1.286 g/cm³; (19)Flash Point: 195.9 °C; (20)Enthalpy of Vaporization: 63.07 kJ/mol; (21)Boiling Point: 382.3 °C at 760 mmHg; (22)Vapour Pressure: 4.76E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)NC(=N2)C3=COC=C3
(2)InChI: InChI=1S/C11H8N2O/c1-2-4-10-9(3-1)12-11(13-10)8-5-6-14-7-8/h1-7H,(H,12,13)
(3)InChIKey: KWLRSTOWOUHFQP-UHFFFAOYSA-N

Product Name

1H-Benzimidazole,2-(3-furanyl)-(9CI)

1H-Benzimidazole,2-(3-furanyl)- Specification

Related Products

Hot Products