Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4-Chloromethyl-2-(2-fluoro-phenyl)-5-methyl-oxazole |
EINECS | N/A |
CAS No. | 671215-76-2 | Density | 1.261 g/cm3 |
PSA | 26.03000 | LogP | 3.52790 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H9ClFNO | Boiling Point | 341.4 °C at 760 mmHg |
Molecular Weight | 225.65 | Flash Point | 160.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Oxazole, 4-(chloromethyl)-2-(2-fluorophenyl)-5-methyl-; |
Article Data | 3 |
The IUPAC name of this chemical is 4-Chloromethyl-2-(2-fluoro-phenyl)-5-methyl-oxazole. With the CAS registry number 671215-76-2, it is also named as oxazole, 4-(chloromethyl)-2-(2-fluorophenyl)-5-methyl-. In addition, the molecular formula is C11H9ClFNO and the molecular weight is 225.65. It should be stored in a cool and dry place.
Physical properties about 4-Chloromethyl-2-(2-fluoro-phenyl)-5-methyl-oxazole are: (1)ACD/LogP: 2.72; (2)ACD/LogD (pH 5.5): 2.72; (3)ACD/LogD (pH 7.4): 2.72; (4)ACD/BCF (pH 5.5): 68.57; (5)ACD/BCF (pH 7.4): 68.57; (6)ACD/KOC (pH 5.5): 717.69; (7)ACD/KOC (pH 7.4): 717.69; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 26.03 Å2; (11)Index of Refraction: 1.536; (12)Molar Refractivity: 55.82 cm3; (13)Molar Volume: 178.9 cm3; (14)Polarizability: 22.12 ×10-24cm3; (15)Surface Tension: 39.5 dyne/cm; (16)Density: 1.261 g/cm3; (17)Flash Point: 160.3 °C; (18)Enthalpy of Vaporization: 56.19 kJ/mol; (19)Boiling Point: 341.4 °C at 760 mmHg; (20)Vapour Pressure: 0.000159 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccccc1c2nc(c(o2)C)CCl
(2)InChI: InChI=1/C11H9ClFNO/c1-7-10(6-12)14-11(15-7)8-4-2-3-5-9(8)13/h2-5H,6H2,1H3
(3)InChIKey: FPUOUVIUAUPHRS-UHFFFAOYAN