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2-Thiazolamine,4-(3-chloro-4-methylphenyl)-5-methyl-

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Name

2-Thiazolamine,4-(3-chloro-4-methylphenyl)-5-methyl-

EINECS N/A
CAS No. 175278-40-7 Density 1.296 g/cm3
PSA 67.88000 LogP 3.59260
Solubility N/A Melting Point N/A
Formula C11H11ClN2S Boiling Point 388.7 °C at 760 mmHg
Molecular Weight 238.741 Flash Point 188.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 175278-40-7 (4-(3-CHLORO-4-METHYLPHENYL)-5-METHYL-1,3-THIAZOL-2-AMINE) Hazard Symbols N/A
Synonyms

4-(3-chloro-4-methylphenyl)-5-methyl-1,3-thiazol-2-amine;

 

2-Thiazolamine,4-(3-chloro-4-methylphenyl)-5-methyl- Specification

The 2-Thiazolamine,4-(3-chloro-4-methylphenyl)-5-methyl-, with the CAS registry number 175278-40-7, is also known as 2-amino-4-(3-chloro-4-methylphenyl)-5-methylthiazole. This chemical's molecular formula is C11H11ClN2S and molecular weight is 238.74.What's more, its systematic name is 4-(3-chloro-4-methylphenyl)-5-methyl-1,3-thiazol-2-amine.

Physical properties about 2-Thiazolamine,4-(3-chloro-4-methylphenyl)-5-methyl- are: (1)ACD/LogP: 3.62; (2)of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.46; (4)ACD/LogD (pH 7.4): 3.62; (5)ACD/BCF (pH 5.5): 231.75; (6)ACD/BCF (pH 7.4): 332.2; (7)ACD/KOC (pH 5.5): 1546.51; (8)ACD/KOC (pH 7.4): 2216.84; (9)H bond acceptors: 2; (10)H bond donors: 2; (11)Freely Rotating Bonds: 1; (12)Polar Surface Area: 44.37 Å2; (13)Index of Refraction: 1.636; (14)Molar Refractivity: 66.1 cm3; (15)Molar Volume: 184.2 cm3; (16)Polarizability: 26.2×10-24 cm3; (17)Surface Tension: 52.1 dyne/cm; (18)Density: 1.296 g/cm3; (19)Flash Point: 188.9 °C; (20)Enthalpy of Vaporization: 63.79 kJ/mol; (21)Boiling Point: 388.7 °C at 760 mmHg; (22)Vapour Pressure: 3.01×10-6 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES:Clc2cc(c1nc(sc1C)N)ccc2CCopyCopied;
(2)InChI:InChI=1/C11H11ClN2S/c1-6-3-4-8(5-9(6)12)10-7(2)15-11(13)14-10/h3-5H,1-2H3,(H2,13,14) CopyCopied;
(3)InChIKey:YMIXNQPUCSSBIW-UHFFFAOYAJ.

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