Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
5-(Chloromethyl)-3-ethyl-1,2,4-oxadiazole |
EINECS | N/A |
CAS No. | 50737-34-3 | Density | 1.23 g/cm3 |
PSA | 38.92000 | LogP | 1.37080 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H7ClN2O | Boiling Point | 220.924 °C at 760 mmHg |
Molecular Weight | 146.576 | Flash Point | 87.412 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,2,4-Oxadiazole, 5-(chloromethyl)-3-ethyl-; |
Article Data | 3 |
The 5-(Chloromethyl)-3-ethyl-1,2,4-oxadiazole is an organic compound with the formula C5H7ClN2O. The systematic name of this chemical is 5-(Chloromethyl)-3-ethyl-1,2,4-oxadiazole. With the CAS registry number 50737-34-3, it is also named as 1,2,4-Oxadiazole, 5-(chloromethyl)-3-ethyl-. Besides, its molecular weight is 146.57.
The physical properties of 5-(Chloromethyl)-3-ethyl-1,2,4-oxadiazole are: (1)ACD/LogP: 1.05; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 2; (5)ACD/BCF (pH 7.4): 2; (6)ACD/KOC (pH 5.5): 46; (7)ACD/KOC (pH 7.4): 46; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 38.92 Å2; (11)Index of Refraction: 1.483; (12)Molar Refractivity: 34.05 cm3; (13)Molar Volume: 119.188 cm3; (14)Polarizability: 13.498×10-24 cm3; (15)Surface Tension: 40.891 dyne/cm; (16)Density: 1.23 g/cm3; (17)Flash Point: 87.412 °C; (18)Enthalpy of Vaporization: 43.874 kJ/mol; (19)Boiling Point: 220.924 °C at 760 mmHg; (20)Vapour Pressure: 0.163 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: ClCc1nc(CC)no1
(2)InChI: InChI=1/C5H7ClN2O/c1-2-4-7-5(3-6)9-8-4/h2-3H2,1H3
(3)InChIKey: RHMCCYHKNUZCCU-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C5H7ClN2O/c1-2-4-7-5(3-6)9-8-4/h2-3H2,1H3
(5)Std. InChIKey: RHMCCYHKNUZCCU-UHFFFAOYSA-N