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852180-70-2

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Basic Information
CAS No.: 852180-70-2
Name: [3-(5-METHYL-1,2,4-OXADIAZOL-3-YL)PHENYL]METHANOL
Article Data: 3
Molecular Structure:
Molecular Structure of 852180-70-2 ([3-(5-METHYL-1,2,4-OXADIAZOL-3-YL)PHENYL]METHANOL)
Formula: C10H10N2O2
Molecular Weight: 190.202
Synonyms: [3-(5-Methyl-1,2,4-oxadiazol-3-yl)phenyl]methanol;
Density: 1.234 g/cm3
Melting Point: 56 °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-(5-methyl-1,2,4-oxadiazol-3-yl)- has the CAS registry number 852180-70-2. This chemical's molecular formula is C10H10N2O2 and molecular weight is 190.2. What's more, its systematic name is [3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]methanol. 

Physical properties of Benzenemethanol,3-(5-methyl-1,2,4-oxadiazol-3-yl)- are: (1)ACD/LogP: 1.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.1; (4)ACD/LogD (pH 7.4): 1.1; (5)ACD/BCF (pH 5.5): 4.01; (6)ACD/BCF (pH 7.4): 4.01; (7)ACD/KOC (pH 5.5): 94.05; (8)ACD/KOC (pH 7.4): 94.05; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 48.15 Å2; (13)Index of Refraction: 1.57; (14)Molar Refractivity: 50.6 cm3; (15)Molar Volume: 154 cm3; (16)Polarizability: 20.06×10-24cm3; (17)Surface Tension: 52.2 dyne/cm; (18)Density: 1.234 g/cm3; (19)Flash Point: 185.5 °C; (20)Enthalpy of Vaporization: 66.62 kJ/mol; (21)Boiling Point: 383.1 °C at 760 mmHg; (22)Vapour Pressure: 1.49E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c(onc1c2cc(ccc2)CO)C
(2)InChI: InChI=1S/C10H10N2O2/c1-7-11-10(12-14-7)9-4-2-3-8(5-9)6-13/h2-5,13H,6H2,1H3
(3)InChIKey: KCLCEECIUZDIGI-UHFFFAOYSA-N