2-Thiazolamine,5-bromo-4-(trifluoromethyl)- supplier

Name
5-bromo-4-trifluoromethyl-thiazole-2-ylamine
EINECS
CAS No. 136411-21-7
Article Data4
CAS DataBase
Density 1.99 g/cm³
Solubility
Melting Point
Formula C₄H₂BrF₃N₂S
Boiling Point 272.951 °C at 760 mmHg
Molecular Weight 247.038
Flash Point 118.877 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Bromo-4-(trifluoromethyl)thiazol-2-amine;
PSA 67.15000
LogP 3.08780

2-Thiazolamine,5-bromo-4-(trifluoromethyl)- Specification

The 2-Thiazolamine,5-bromo-4-(trifluoromethyl)-, with the CAS registry number 136411-21-7, is also known as 5-Bromo-4-(trifluoromethyl)thiazol-2-amine. This chemical's molecular formula is C₄H₂BrF₃N₂S and molecular weight is 247.0363. Its systematic name is called 5-bromo-4-(trifluoromethyl)-1,3-thiazol-2-amine.

Physical properties of 2-Thiazolamine,5-bromo-4-(trifluoromethyl)-: (1)ACD/LogP: 1.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 10; (6)ACD/BCF (pH 7.4): 10; (7)ACD/KOC (pH 5.5): 179; (8)ACD/KOC (pH 7.4): 179; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.552; (13)Molar Refractivity: 39.635 cm³; (14)Molar Volume: 124.112 cm³; (15)Surface Tension: 43.161 dyne/cm; (16)Density: 1.99 g/cm³; (17)Flash Point: 118.877 °C; (18)Enthalpy of Vaporization: 51.127 kJ/mol; (19)Boiling Point: 272.951 °C at 760 mmHg; (20)Vapour Pressure: 0.006 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1sc(N)nc1C(F)(F)F
(2)InChI: InChI=1/C4H2BrF3N2S/c5-2-1(4(6,7)8)10-3(9)11-2/h(H2,9,10)
(3)InChIKey: DSEAYBLLHONPRM-UHFFFAOYAF

Product Name

5-bromo-4-trifluoromethyl-thiazole-2-ylamine

2-Thiazolamine,5-bromo-4-(trifluoromethyl)- Specification

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