Basic Information | Post buying leads | Suppliers |
Name |
Benzenemethanol,3-(3-methyl-1,2,4-oxadiazol-5-yl)- |
EINECS | N/A |
CAS No. | 916766-84-2 | Density | 1.234g/cm3 |
PSA | 59.15000 | LogP | 1.53730 |
Solubility | N/A | Melting Point |
85.5-88.5°C |
Formula | C10H10N2O2 | Boiling Point | 383.1 °C at 760 mmHg |
Molecular Weight | 190.1986 | Flash Point | 185.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
[3-(3-Methyl-1,2,4-oxadiazol-5-yl)phenyl]methanol;3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl alcohol;3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl alcohol 97% |
The Benzenemethanol,3-(3-methyl-1,2,4-oxadiazol-5-yl)-, with CAS registry number 916766-84-2, has the systematic name of [3-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methanol. Besides this, it is also called 3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl alcohol. And the chemical formula of this chemical is C10H10N2O2.
Physical properties of Benzenemethanol,3-(3-methyl-1,2,4-oxadiazol-5-yl)-: (1)ACD/LogP: 0.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.78; (4)ACD/LogD (pH 7.4): 0.78; (5)#H bond acceptors: 4; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 59.15 Å2; (9)Index of Refraction: 1.57; (10)Molar Refractivity: 50.6 cm3; (11)Molar Volume: 154 cm3; (12)Polarizability: 20.06×10-24cm3; (13)Surface Tension: 52.2 dyne/cm; (14)Density: 1.234 g/cm3; (15)Flash Point: 185.5 °C; (16)Enthalpy of Vaporization: 66.62 kJ/mol; (17)Boiling Point: 383.1 °C at 760 mmHg; (18)Vapour Pressure: 1.49E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1nc(on1)c2cccc(c2)CO
(2)InChI: InChI=1/C10H10N2O2/c1-7-11-10(14-12-7)9-4-2-3-8(5-9)6-13/h2-5,13H,6H2,1H3
(3)InChIKey: ZBIYTANHMLGZFB-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C10H10N2O2/c1-7-11-10(14-12-7)9-4-2-3-8(5-9)6-13/h2-5,13H,6H2,1H3
(5)Std. InChIKey: ZBIYTANHMLGZFB-UHFFFAOYSA-N