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4-Bromo-5-methyl-2-thiazolamine

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Name

4-Bromo-5-methyl-2-thiazolamine

EINECS N/A
CAS No. 1209167-05-4 Density 1.806 g/cm3
PSA 67.88000 LogP 1.72630
Solubility N/A Melting Point N/A
Formula C4H5BrN2S Boiling Point 298.3 °C at 760 mmHg
Molecular Weight 193.067 Flash Point 134.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1209167-05-4 (4-Bromo-5-methyl-2-thiazolamine) Hazard Symbols N/A
Synonyms

2-Thiazolamine, 4-bromo-5-methyl-;

 

4-Bromo-5-methyl-2-thiazolamine Specification

The 4-Bromo-5-methyl-2-thiazolamine, with the CAS registry number of 1209167-05-4, is also known as 2-Thiazolamine, 4-bromo-5-methyl-. Its molecular formula is C4H5BrN2S and molecular weight is 193.0649. What's more, its systematic name is 4-Bromo-5-methyl-1,3-thiazol-2-amine.

Physical properties about the 4-Bromo-5-methyl-2-thiazolamine are: (1)ACD/LogP: 1.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.59; (4)ACD/LogD (pH 7.4): 1.61; (5)ACD/BCF (pH 5.5): 9.39; (6)ACD/BCF (pH 7.4): 9.88; (7)ACD/KOC (pH 5.5): 170.46; (8)ACD/KOC (pH 7.4): 179.28; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 67.15 Å2; (13)Index of Refraction: 1.66; (14)Molar Refractivity: 39.47 cm3; (15)Molar Volume: 106.8 cm3; (16)Surface Tension: 60.8 dyne/cm; (17)Density: 1.806 g/cm3; (18)Flash Point: 134.2 °C; (19)Enthalpy of Vaporization: 53.82 kJ/mol; (20)Boiling Point: 298.3 °C at 760 mmHg; (21)Vapour Pressure: 0.00128 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cc1c(nc(s1)N)Br
(2) InChI: InChI=1/C4H5BrN2S/c1-2-3(5)7-4(6)8-2/h1H3,(H2,6,7)
(3) InChIKey: KPTFKWPRFDQHJL-UHFFFAOYAV

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