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65705-44-4

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Basic Information
CAS No.: 65705-44-4
Name: 4-(4-BROMOPHENYL)-5-METHYL-1,3-THIAZOLE-2-YLAMINE
Article Data: 2
Molecular Structure:
Molecular Structure of 65705-44-4 (4-(4-BROMOPHENYL)-5-METHYL-1,3-THIAZOLE-2-YLAMINE)
Formula: C10H9BrN2S
Molecular Weight: 269.165
Synonyms: 4-(4-Bromophenyl)-5-methyl-2-thiazolamine;
Density: 1.563 g/cm3
Melting Point: 396.8 °C at 760 mmHg
Boiling Point: 193.8 °C
Flash Point: 193.8°C
Appearance: solid
Hazard Symbols: Xn
Risk Codes: 20/21/22
Safety: 26-36/37/39
PSA: 67.15000
LogP: 4.04440
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    Molecular Formula: C10H9BrN2S Formula Weight: 269.16

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Specification

The 2-Thiazolamine,4-(4-bromophenyl)-5-methyl-, with the CAS registry number 65705-44-4, is also known as 4-(4-Bromophenyl)-5-methyl-2-thiazolamine. It belongs to the product categories of Amines; Thiazoles, Isothiazoles & Benzothiazoles. This chemical's molecular formula is C10H9BrN2S and molecular weight is 269.16. Its systematic name is called 4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-amine. 

Physical properties of 2-Thiazolamine,4-(4-bromophenyl)-5-methyl-: (1)ACD/LogP: 3.50; (2)ACD/LogD (pH 5.5): 3.37; (3)ACD/LogD (pH 7.4): 3.5; (4)ACD/BCF (pH 5.5): 200.54; (5)ACD/BCF (pH 7.4): 268.77; (6)ACD/KOC (pH 5.5): 1421.81; (7)ACD/KOC (pH 7.4): 1905.57; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.666; (12)Molar Refractivity: 64.07 cm3; (13)Molar Volume: 172.1 cm3; (14)Surface Tension: 56.4 dyne/cm; (15)Density: 1.563 g/cm3; (16)Flash Point: 193.8 °C; (17)Enthalpy of Vaporization: 64.71 kJ/mol; (18)Boiling Point: 396.8 °C at 760 mmHg; (19)Vapour Pressure: 1.67E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccc(c1nc(sc1C)N)cc2
(2)InChI: InChI=1/C10H9BrN2S/c1-6-9(13-10(12)14-6)7-2-4-8(11)5-3-7/h2-5H,1H3,(H2,12,13)
(3)InChIKey: ULSZADQFOHESKR-UHFFFAOYAR