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124937-62-8

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Basic Information
CAS No.: 124937-62-8
Name: Methyl 3-(2-methoxy-5-methylphenyl)-3-phenylpropionate
Article Data: 1
Molecular Structure:
Molecular Structure of 124937-62-8 (Methyl 3-(2-methoxy-5-methylphenyl)-3-phenylpropionate)
Formula: C18H20O3
Molecular Weight: 284.35
Synonyms: Methyl2-(3-hydroxy-5-methylphenyl)propionate;
Density: 1.082 g/cm3
Boiling Point: 401.781 °C at 760 mmHg
Flash Point: 169.975 °C
PSA: 35.53000
LogP: 3.69860
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Specification

The Methyl 3-(2-methoxy-5-methylphenyl)-3-phenylpropionate, its cas register number is 124937-62-8. It also can be called as Benzenepropanoic acid,2-methoxy-5-methyl-b-phenyl-, methyl ester and the Systematic name about this chemical is Methyl 3-(2-methoxy-5-methylphenyl)-3-phenylpropanoate. It belongs to the following product categories, such as (intermeidate of tolterodine).

Physical properties about Methyl 3-(2-methoxy-5-methylphenyl)-3-phenylpropionate are: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 35.53Å2; (5)Index of Refraction: 1.542; (6)Molar Refractivity: 82.74 cm3; (7)Molar Volume: 262.8 cm3; (8)Polarizability: 32.8x10-24cm3; (9)Surface Tension: 38.6 dyne/cm; (10)Enthalpy of Vaporization: 65.28 kJ/mol; (11)Vapour Pressure: 1.15E-06 mmHg at 25°C

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)CC(c1cc(ccc1OC)C)c2ccccc2
(2)InChI: InChI=1/C18H20O3/c1-13-9-10-17(20-2)16(11-13)15(12-18(19)21-3)14-7-5-4-6-8-14/h4-11,15H,12H2,1-3H3
(3)InChIKey: BJQJPTJDNINOMT-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C18H20O3/c1-13-9-10-17(20-2)16(11-13)15(12-18(19)21-3)14-7-5-4-6-8-14/h4-11,15H,12H2,1-3H3
(5)Std. InChIKey: BJQJPTJDNINOMT-UHFFFAOYSA-N