2-Thiazolamine,4-(4-methoxyphenyl)-5-methyl- supplier

Name
4-(4-METHOXY-PHENYL)-5-METHYL-THIAZOL-2-YLAMINE
EINECS
CAS No. 105512-88-7
Article Data4
CAS DataBase
Density 1.223 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₂N₂OS
Boiling Point 384.9 °C at 760 mmHg
Molecular Weight 220.295
Flash Point 186.6 °C
Transport Information
Appearance
Safety
Risk Codes Xi:;
Molecular Structure
Hazard Symbols Xi
Synonyms 4-(4-Methoxyphenyl)-5-methyl-1,3-thiazol-2(3H)-imine;4-(4-Methoxyphenyl)-5-methyl-1,3-thiazol-2-amine;
PSA 76.38000
LogP 3.29050

2-Thiazolamine,4-(4-methoxyphenyl)-5-methyl- Specification

The 2-Thiazolamine,4-(4-methoxyphenyl)-5-methyl- is an organic compound with the formula C₁₁H₁₂N₂OS. The IUPAC name of this chemical is 4-(4-Methoxyphenyl)-5-methyl-1,3-thiazol-2-amine. With the CAS registry number 105512-88-7, it is also named as 4-(4-Methoxyphenyl)-5-methyl-1,3-thiazol-2(3H)-imine. Besides, its molecular weight is 220.29.

The physical properties of 2-Thiazolamine,4-(4-methoxyphenyl)-5-methyl- are: (1)ACD/LogP: 2.41; (2)ACD/LogD (pH 5.5): 1.74; (3)ACD/LogD (pH 7.4): 2.39; (4)ACD/BCF (pH 5.5): 8.45; (5)ACD/BCF (pH 7.4): 38.32; (6)ACD/KOC (pH 5.5): 102.94; (7)ACD/KOC (pH 7.4): 466.99; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 53.6 Å²; (12)Index of Refraction: 1.618; (13)Molar Refractivity: 63.05 cm³; (14)Molar Volume: 179.9 cm³; (15)Polarizability: 24.99×10^-24 cm³; (16)Surface Tension: 49.7 dyne/cm; (17)Density: 1.223 g/cm³; (18)Flash Point: 186.6 °C; (19)Enthalpy of Vaporization: 63.37 kJ/mol; (20)Boiling Point: 384.9 °C at 760 mmHg; (21)Vapour Pressure: 3.95E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: n2c(c1ccc(OC)cc1)c(sc2N)C
(2)InChI: InChI=1/C11H12N2OS/c1-7-10(13-11(12)15-7)8-3-5-9(14-2)6-4-8/h3-6H,1-2H3,(H2,12,13)
(3)InChIKey: WUTXFLYFZOMYSF-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C11H12N2OS/c1-7-10(13-11(12)15-7)8-3-5-9(14-2)6-4-8/h3-6H,1-2H3,(H2,12,13)
(5)Std. InChIKey: WUTXFLYFZOMYSF-UHFFFAOYSA-N

Product Name

4-(4-METHOXY-PHENYL)-5-METHYL-THIAZOL-2-YLAMINE

2-Thiazolamine,4-(4-methoxyphenyl)-5-methyl- Specification

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