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Name |
1H-Imidazole,2-(2-ethyl-2,3-dihydro-2-benzofuranyl)- |
EINECS | N/A |
CAS No. | 189224-48-4 | Density | 1.181 g/cm3 |
PSA | 37.91000 | LogP | 2.65010 |
Solubility | N/A | Melting Point |
137-139oC |
Formula | C13H14N2O | Boiling Point | 428.1 °C at 760 mmHg |
Molecular Weight | 214.26 | Flash Point | 154.4 °C |
Transport Information | N/A | Appearance | White Solid |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
KU 14R;2-(2-Ethyl-2,3-dihydrobenzofuran-2-yl)-1H-imidazole; |
The 1H-Imidazole, 2-(2-ethyl-2, 3-dihydro-2-benzofuranyl)-, with the CAS registry number 189224-48-4, is also known as 2-(2-Ethyl-2, 3-dihydrobenzofuran-2-yl)-1H-imidazole. It belongs to the product category of Imidazoline Binding Site. This chemical's molecular formula is C13H14N2O and molecular weight is 214.26. What's more, its systematic name is 2-(2-Ethyl-2, 3-dihydro-1-benzofuran-2-yl)-1H-imidazole. In addition, it can be stored at room temperature.
Physical properties about 1H-Imidazole, 2-(2-ethyl-2, 3-dihydro-2-benzofuranyl)- are: (1)ACD/LogP: 2.10; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 27.05 Å2; (7)Index of Refraction: 1.595; (8)Molar Refractivity: 61.62 cm3; (9)Molar Volume: 181.3 cm3; (10)Polarizability: 24.42×10-24 cm3; (11)Surface Tension: 54.9 dyne/cm; (12)Density: 1.181 g/cm3; (13)Flash Point: 154.4 °C; (14)Enthalpy of Vaporization: 65.67 kJ/mol; (15)Boiling Point: 428.1 °C at 760 mmHg; (16)Vapour Pressure: 3.89E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: n1ccnc1C3(Oc2ccccc2C3)CC
(2) InChI: InChI=1/C13H14N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-8H,2,9H2,1H3,(H,14,15)
(3) InChIKey: JCWVNNMJXQJVNC-UHFFFAOYAM