4,6-Dichloro-5-nitro-2-(trifluoromethyl)pyrimidine supplier

Name
4,6-Dichloro-5-nitro-2-(trifluoromethyl)pyrimidine
EINECS
CAS No. 715-46-8
Article Data5
CAS DataBase
Density 1.805 g/cm³
Solubility
Melting Point
Formula C₅Cl₂F₃N₃O₂
Boiling Point 249.7 °C at 760 mmHg
Molecular Weight 261.97
Flash Point 104.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms IFLAB-BB F2124-0831;AKOS A0602-0707;Pyrimidine, 4,6-dichloro-5-nitro-2-(trifluoromethyl)-;
PSA 71.60000
LogP 3.23360

4,6-Dichloro-5-nitro-2-(trifluoromethyl)pyrimidine Specification

This chemical is called 4,6-Dichloro-5-nitro-2-(trifluoromethyl)pyrimidine, and its CAS registry number is 715-46-8. With the molecular formula of C₅Cl₂F₃N₃O₂, its molecular weight is 261.97.

Other characteristics of the 4,6-Dichloro-5-nitro-2-(trifluoromethyl)pyrimidine can be summarised as followings: (1)ACD/LogP: 1.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.23; (4)ACD/LogD (pH 7.4): 1.23; (5)ACD/BCF (pH 5.5): 5.07; (6)ACD/BCF (pH 7.4): 5.07; (7)ACD/KOC (pH 5.5): 111.18; (8)ACD/KOC (pH 7.4): 111.18; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 71.6 Å²; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 43.75 cm³; (15)Molar Volume: 145.1 cm³; (16)Polarizability: 17.34×10^-24cm³; (17)Surface Tension: 46.9 dyne/cm; (18)Density: 1.805 g/cm³; (19)Flash Point: 104.8 °C; (20)Enthalpy of Vaporization: 46.72 kJ/mol; (21)Boiling Point: 249.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0357 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Clc1nc(nc(Cl)c1N(=O)=O)C(F)(F)F
2.InChI: InChI=1/C5Cl2F3N3O2/c6-2-1(13(14)15)3(7)12-4(11-2)5(8,9)10
3.InChIKey: YJCAJZCDJPUTJQ-UHFFFAOYAP

Product Name

4,6-Dichloro-5-nitro-2-(trifluoromethyl)pyrimidine

4,6-Dichloro-5-nitro-2-(trifluoromethyl)pyrimidine Specification

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