Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
1H-Benzimidazole,2-(chloromethyl)-1-phenyl- |
EINECS | N/A |
CAS No. | 94937-86-7 | Density | 1.23 g/cm3 |
PSA | 17.82000 | LogP | 3.76430 |
Solubility | N/A | Melting Point |
N/A |
Formula | C14H11ClN2 | Boiling Point | 408.9 °C at 760 mmHg |
Molecular Weight | 242.708 | Flash Point | 201.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1-Phenyl-2-(chloromethyl)benzimidazole;2-Chloromethyl-1-phenyl-1H-benzimidazole; |
Article Data | 4 |
The 1H-Benzimidazole,2-(chloromethyl)-1-phenyl- is an organic compound with the formula C14H11ClN2. With the CAS registry number 94937-86-7, the systematic name of this chemical is 2-(chloromethyl)-1-phenyl-1H-benzimidazole.
Physical properties about 1H-Benzimidazole,2-(chloromethyl)-1-phenyl- are: (1)ACD/LogP: 4.12; (2)ACD/LogD (pH 5.5): 4.08; (3)ACD/LogD (pH 7.4): 4.12; (4)ACD/BCF (pH 5.5): 728.92; (5)ACD/BCF (pH 7.4): 791.59; (6)ACD/KOC (pH 5.5): 3805.33; (7)ACD/KOC (pH 7.4): 4132.49; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 17.82 Å2; (11)Index of Refraction: 1.639; (12)Molar Refractivity: 71.02 cm3; (13)Molar Volume: 197.2 cm3; (14)Polarizability: 28.15×10-24cm3; (15)Surface Tension: 45.8 dyne/cm; (16)Density: 1.23 g/cm3; (17)Flash Point: 201.1 °C; (18)Enthalpy of Vaporization: 66.1 kJ/mol; (19)Boiling Point: 408.9 °C at 760 mmHg; (20)Vapour Pressure: 6.78E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: ClCc2nc1ccccc1n2c3ccccc3
(2)InChI: InChI=1/C14H11ClN2/c15-10-14-16-12-8-4-5-9-13(12)17(14)11-6-2-1-3-7-11/h1-9H,10H2
(3)InChIKey: TYOBCMJTBPLYGR-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C14H11ClN2/c15-10-14-16-12-8-4-5-9-13(12)17(14)11-6-2-1-3-7-11/h1-9H,10H2
(5)Std. InChIKey: TYOBCMJTBPLYGR-UHFFFAOYSA-N