5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine supplier

Name
5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine
EINECS
CAS No. 1214377-42-0
Article Data6
CAS DataBase
Density 1.637 g/cm³
Solubility
Melting Point
Formula C₇H₅BrF₃NO
Boiling Point 208 °C at 760 mmHg
Molecular Weight 256.02
Flash Point 79.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyridine, 5-bromo-2-methoxy-3-(trifluoromethyl)-;
PSA 22.12000
LogP 2.87150

5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine Specification

The chemical with CAS registry number of 1214377-42-0 is known as 5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine. The systematic name is Pyridine, 5-bromo-2-methoxy-3-(trifluoromethyl)-. In addition, the formula is C₇H₅BrF₃NO and the molecular weight is 256.02.

Physical properties about 5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine are: (1)ACD/LogP: 3.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.34; (4)ACD/LogD (pH 7.4): 3.34; (5)ACD/BCF (pH 5.5): 201.87; (6)ACD/BCF (pH 7.4): 201.87; (7)ACD/KOC (pH 5.5): 1554.46; (8)ACD/KOC (pH 7.4): 1554.46; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 22.12Å²; (13)Index of Refraction: 1.47; (14)Molar Refractivity: 43.69 cm³; (15)Molar Volume: 156.3 cm³; (16)Polarizability: 17.32×10^-24cm³; (17)Surface Tension: 29.9 dyne/cm; (18)Density: 1.637 g/cm³; (19)Flash Point: 79.6 °C; (20)Enthalpy of Vaporization: 42.61 kJ/mol; (21)Boiling Point: 208 °C at 760 mmHg; (22)Vapour Pressure: 0.316 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: COc1c(cc(cn1)Br)C(F)(F)F
2. InChI: InChI=1/C7H5BrF3NO/c1-13-6-5(7(9,10)11)2-4(8)3-12-6/h2-3H,1H3
3. InChIKey: ZIOFHXRZJCIBCO-UHFFFAOYAT
4. Std. InChI: InChI=1S/C7H5BrF3NO/c1-13-6-5(7(9,10)11)2-4(8)3-12-6/h2-3H,1H3
5. Std. InChIKey: ZIOFHXRZJCIBCO-UHFFFAOYSA-N

Product Name

5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine

5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine Specification

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