2-Chloro-6-(trifluoromethyl)pyrimidin-4-amine supplier

Name
2-Chloro-6-(trifluoromethyl)pyrimidin-4-amine
EINECS
CAS No. 85730-36-5
Density 1.598g/cm³
Solubility
Melting Point 191-192 °C
Formula C₅H₃ClF₃N₃
Boiling Point 315.963 °C at 760 mmHg
Molecular Weight 197.547
Flash Point 144.889 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-pyrimidinamine, 2-chloro-6-(trifluoromethyl)-;
PSA 51.80000
LogP 2.31220

2-Chloro-6-(trifluoromethyl)pyrimidin-4-amine Specification

The 2-Chloro-6-(trifluoromethyl)pyrimidin-4-amine, with CAS registry number 85730-36-5, has the systematic name of 2-chloro-6-(trifluoromethyl)pyrimidin-4-amine. Besides this, it is also called 4-pyrimidinamine, 2-chloro-6-(trifluoromethyl)-. And the chemical formula of this chemical is C₅H₃ClF₃N₃.

Physical properties of 2-Chloro-6-(trifluoromethyl)pyrimidin-4-amine: (1)ACD/LogP: 0.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 46; (8)ACD/KOC (pH 7.4): 46; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 51.8 Å²; (13)Index of Refraction: 1.503; (14)Molar Refractivity: 36.546 cm³; (15)Molar Volume: 123.622 cm³; (16)Polarizability: 14.488×10^-24cm³; (17)Surface Tension: 41.877 dyne/cm; (18)Enthalpy of Vaporization: 55.725 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cc(N)nc(Cl)n1
(2)InChI: InChI=1/C5H3ClF3N3/c6-4-11-2(5(7,8)9)1-3(10)12-4/h1H,(H2,10,11,12)
(3)InChIKey: XPOXHSQGNDLFPT-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C5H3ClF3N3/c6-4-11-2(5(7,8)9)1-3(10)12-4/h1H,(H2,10,11,12)
(5)Std. InChIKey: XPOXHSQGNDLFPT-UHFFFAOYSA-N

Product Name

2-Chloro-6-(trifluoromethyl)pyrimidin-4-amine

2-Chloro-6-(trifluoromethyl)pyrimidin-4-amine Specification

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