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175136-29-5

Basic Information
CAS No.: 175136-29-5
Name: METHYL 2-(5-METHYL-2-PHENYL-1,3-THIAZOL-4-YL)ACETATE
Article Data: 4
Molecular Structure:
Molecular Structure of 175136-29-5 (METHYL 2-(5-METHYL-2-PHENYL-1,3-THIAZOL-4-YL)ACETATE)
Formula: C13H13NO2S
Molecular Weight: 247.31
Synonyms: (5-Methyl-2-phenylthiazol-4-yl)aceticacid methyl ester;
Density: 1.197g/cm3
Melting Point: 42 °C
Boiling Point: 381.6 °C at 760 mmHg
Flash Point: 184.6 °C
PSA: 67.43000
LogP: 2.83400
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  • Methyl 2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetate

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    Methyl 2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetate

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    As a leading manufacturer and supplier of chemicals in China, DayangChem not only supply popular chemicals, but also DayangChem’s R&D center offer custom synthesis according to the contract research and development services for the fine chemicals, ph

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  • 4-Thiazoleaceticacid, 5-methyl-2-phenyl-, methyl ester

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    175136-29-5

    4-Thiazoleaceticacid, 5-methyl-2-phenyl-, methyl ester

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  • Methyl 2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetate, 97%

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    Methyl 2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetate, 97%

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    Ansciep Chemical is a professional enterprise manufacturing and distributing fine chemicals and speciality chemicals. We have been dedicated to heterocycle compounds and phenyl rings for tens of years. This is our mature product for export. Our quali

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  • METHYL 2-(5-METHYL-2-PHENYL-1,3-THIAZOL-4-YL)ACETATE

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    175136-29-5

    METHYL 2-(5-METHYL-2-PHENYL-1,3-THIAZOL-4-YL)ACETATE

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    FINETECH INDUSTRY LIMITED is a LONDON based CRO company providing drug discovery & development services to worldwide clients. FINETECH INDUSTRY LIMITED supplies the METHYL 2-(5-METHYL-2-PHENYL-1,3-THIAZOL-4-YL)ACETATE, CAS:175136-29-5 with the most c

    Finetech Industry Limited is a company in England,which specializing in developing, manufacturing and marketing fine organic compounds and intermediates for the fine chemical and p

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Specification

The 4-Thiazoleaceticacid, 5-methyl-2-phenyl-, methyl ester, with CAS registry number 175136-29-5, has the systematic name of methyl (5-methyl-2-phenyl-1,3-thiazol-4-yl)acetate. Besides this, it is also called Methyl (5-methyl-2-phenylthiazol-4-yl)acetate. And the chemical formula of this chemical is C13H13NO2S.

Physical properties of 4-Thiazoleaceticacid, 5-methyl-2-phenyl-, methyl ester: (1)ACD/LogP: 3.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.45; (4)ACD/LogD (pH 7.4): 3.45; (5)ACD/BCF (pH 5.5): 245.15; (6)ACD/BCF (pH 7.4): 245.37; (7)ACD/KOC (pH 5.5): 1785.89; (8)ACD/KOC (pH 7.4): 1787.47; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 67.43 Å2; (13)Index of Refraction: 1.573; (14)Molar Refractivity: 68.1 cm3; (15)Molar Volume: 206.5 cm3; (16)Polarizability: 26.99×10-24cm3; (17)Surface Tension: 45.6 dyne/cm; (18)Density: 1.197 g/cm3; (19)Flash Point: 184.6 °C; (20)Enthalpy of Vaporization: 62.99 kJ/mol; (21)Boiling Point: 381.6 °C at 760 mmHg; (22)Vapour Pressure: 5.02E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)Cc1nc(sc1C)c2ccccc2
(2)InChI: InChI=1/C13H13NO2S/c1-9-11(8-12(15)16-2)14-13(17-9)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3
(3)InChIKey: IGRGQWSVDTYHID-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C13H13NO2S/c1-9-11(8-12(15)16-2)14-13(17-9)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3
(5)Std. InChIKey: IGRGQWSVDTYHID-UHFFFAOYSA-N