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157169-71-6

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Basic Information
CAS No.: 157169-71-6
Name: 2-[5-METHYL-2-(4-METHYLPHENYL)-1,3-OXAZOL-4-YL]ETHANOL
Article Data: 8
Molecular Structure:
Molecular Structure of 157169-71-6 (2-[5-METHYL-2-(4-METHYLPHENYL)-1,3-OXAZOL-4-YL]ETHANOL)
Formula: C13H15NO2
Molecular Weight: 217.268
Synonyms: 2-[5-Methyl-2-(4-methylphenyl)oxazol-4-yl]ethanol;2-[5-Methyl-2-(p-tolyl)oxazol-4-yl]ethanol;
Density: 1.122 g/cm3
Melting Point: 61 °C
Boiling Point: 374.892 °C at 760 mmHg
Flash Point: 180.528 °C
PSA: 46.26000
LogP: 2.49320
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  • 2-[5-METHYL-2-(4-METHYLPHENYL)-1,3-OXAZOL-4-YL]ETHANOL

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    2-[5-METHYL-2-(4-METHYLPHENYL)-1,3-OXAZOL-4-YL]ETHANOLAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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    4-Oxazoleethanol,5-methyl-2-(4-methylphenyl)-

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  • 2-[5-Methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethanol

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    2-[5-Methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethanol

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    2-[5-METHYL-2-(4-METHYLPHENYL)-1,3-OXAZOL-4-YL]ETHANOL CASNumber: 157169-71-6 Formula: C13H15NO2 MW: 217.27 Purity: 97+%

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Specification

The CAS registry number of 4-Oxazoleethanol,5-methyl-2-(4-methylphenyl)- is 157169-71-6. The systematic name is 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethanol. In addition, the molecular formula is C13H15NO2 and the molecular weight is 217.26. What's more, it should be stored in sealed container, and put in a cool and dry place.

Other characteristics of the 4-Oxazoleethanol,5-methyl-2-(4-methylphenyl)- can be summarised as followings: (1)ACD/LogP: 1.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 41; (6)ACD/BCF (pH 7.4): 41; (7)ACD/KOC (pH 5.5): 494; (8)ACD/KOC (pH 7.4): 494; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 46.26 Å2; (13)Index of Refraction: 1.553; (14)Molar Refractivity: 61.97 cm3; (15)Molar Volume: 193.61 cm3; (16)Polarizability: 24.567×10-24cm3; (17)Surface Tension: 43.553 dyne/cm; (18)Density: 1.122 g/cm3; (19)Flash Point: 180.528 °C; (20)Enthalpy of Vaporization: 65.652 kJ/mol; (21)Boiling Point: 374.892 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c(c(oc1c2ccc(cc2)C)C)CCO
(2)InChI: InChI=1/C13H15NO2/c1-9-3-5-11(6-4-9)13-14-12(7-8-15)10(2)16-13/h3-6,15H,7-8H2,1-2H3
(3)InChIKey: WTABRJGSWMZKOR-UHFFFAOYAV