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Basic Information
CAS No.: 916766-84-2
Name: 3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl alcohol
Molecular Structure:
Molecular Structure of 916766-84-2 (3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl alcohol)
Formula: C10H10N2O2
Molecular Weight: 190.1986
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%
Density: 1.234g/cm3
Melting Point: 85.5-88.5°C
Boiling Point: 383.1 °C at 760 mmHg
Flash Point: 185.5 °C
PSA: 59.15000
LogP: 1.53730
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Specification

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