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| CAS No.: | 169260-97-3 |
|---|---|
| Name: | 5-(trifluoromethyl)thiazol-2-amine |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C4H3F3N2S |
| Molecular Weight: | 168.142 |
| Synonyms: | 5-(Trifluoromethyl)-1,3-thiazol-2-amine;5-(Trifluoromethyl)thiazol-2-amine; |
| Density: | 1.557 g/cm3 |
| Boiling Point: | 214 °C at 760 mmHg |
| Flash Point: | 83.2 °C |
| PSA: | 67.15000 |
| LogP: | 2.32530 |
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Specification
The 2-Thiazolamine, 5-(trifluoromethyl)-, with the CAS registry number 169260-97-3, is also known as 5-(Trifluoromethyl)thiazol-2-amine. This chemical's molecular formula is C4H3F3N2S and molecular weight is 168.14. What's more, its systematic name is 5-(trifluoromethyl)-1,3-thiazol-2-amine.
Physical properties of 2-Thiazolamine, 5-(trifluoromethyl)- are: (1)ACD/LogP: 0.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.95; (4)ACD/LogD (pH 7.4): 0.95; (5)ACD/BCF (pH 5.5): 3.1; (6)ACD/BCF (pH 7.4): 3.11; (7)ACD/KOC (pH 5.5): 78.13; (8)ACD/KOC (pH 7.4): 78.47; (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: 1.503; (14)Molar Refractivity: 31.94 cm3; (15)Molar Volume: 107.9 cm3; (16)Polarizability: 12.66×10-24cm3; (17)Surface Tension: 37.8 dyne/cm; (18)Density: 1.557 g/cm3; (19)Flash Point: 83.2 °C; (20)Enthalpy of Vaporization: 45.03 kJ/mol; (21)Boiling Point: 214 °C at 760 mmHg; (22)Vapour Pressure: 0.16 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cnc(N)s1
(2)InChI: InChI=1S/C4H3F3N2S/c5-4(6,7)2-1-9-3(8)10-2/h1H,(H2,8,9)
(3)InChIKey: DMGAMZGETZDLBL-UHFFFAOYSA-N