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926921-57-5

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Basic Information
CAS No.: 926921-57-5
Name: 3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl bromide
Molecular Structure:
Molecular Structure of 926921-57-5 (3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl bromide)
Formula: C10H9BrN2O
Molecular Weight: 253.0953
Synonyms: 3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl bromide 97%;
Density: 1.491 g/cm3
Melting Point: 66-67.5 °C
Boiling Point: 369.4 °C at 760 mmHg
Flash Point: 177.2 °C
Hazard Symbols: CorrosiveC
PSA: 38.92000
LogP: 2.93990
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    3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl bromide 97%

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  • 5-[3-(bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole

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    5-[3-(bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole

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Specification

The 3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl bromide, with the CAS registry number 926921-57-5, is also known as 3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl bromide 97%. This chemical's molecular formula is C10H9BrN2O and molecular weight is 253.0953. Its systematic name is called 5-[3-(bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole. When you are using this chemical, please be cautious about it. This chemical may destroy living tissue on contact.

Physical properties of 3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzyl bromide: (1)ACD/LogP: 2.66; (2)ACD/LogD (pH 5.5): 2.66; (3)ACD/LogD (pH 7.4): 2.66; (4)#H bond acceptors: 3; (5)#Freely Rotating Bonds: 2; (6)Index of Refraction: 1.583; (7)Molar Refractivity: 56.8 cm3; (8)Molar Volume: 169.7 cm3; (9)Surface Tension: 49.1 dyne/cm; (10)Density: 1.491 g/cm3; (11)Flash Point: 177.2 °C; (12)Enthalpy of Vaporization: 59.19 kJ/mol; (13)Boiling Point: 369.4 °C at 760 mmHg; (14)Vapour Pressure: 2.54E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1nc(on1)c2cccc(c2)CBr
(2)InChI: InChI=1/C10H9BrN2O/c1-7-12-10(14-13-7)9-4-2-3-8(5-9)6-11/h2-5H,6H2,1H3
(3)InChIKey: WKTARCMEMVHRLR-UHFFFAOYAE