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2-Chloro-5-(trifluoromethyl)-4-pyridinecarboxaldehyde

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Name

2-Chloro-5-(trifluoromethyl)-4-pyridinecarboxaldehyde

EINECS N/A
CAS No. 505084-57-1 Density 1.499 g/cm3
PSA 29.96000 LogP 2.56630
Solubility N/A Melting Point N/A
Formula C7H3ClF3NO Boiling Point 254.1 °C at 760 mmHg
Molecular Weight 209.555 Flash Point 107.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 505084-57-1 (2-CHLORO-5-(TRIFLUOROMETHYL)-PYRIDINE-4-CARBOXALDEHYDE) Hazard Symbols N/A
Synonyms

2-CHLORO-5-(TRIFLUOROMETHYL)-PYRIDINE-4-CARBOXALDEHYDE;2-CHLORO-5-(TRIFLUOROMETHYL)-4-PYRIDINECARBOXALDEHYDE;2-CHLORO-5-(TRIFLUOR;2-Chloro-5-(trifluoroMethyl)isonicotinaldehyde

 

2-Chloro-5-(trifluoromethyl)-4-pyridinecarboxaldehyde Specification

The 2-Chloro-5-(trifluoromethyl)-4-pyridinecarboxaldehyde is an organic compound with the formula C7H3ClF3NO. The systematic name of this chemical is 2-chloro-5-(trifluoromethyl)pyridine-4-carbaldehyde. With the CAS registry number 505084-57-1, it is also named as 4-pyridinecarboxaldehyde, 2-chloro-5-(trifluoromethyl)-.

Physical properties about 2-Chloro-5-(trifluoromethyl)-4-pyridinecarboxaldehyde are: (1)ACD/LogP: 2.17; (2)ACD/LogD (pH 5.5): 2.17; (3)ACD/LogD (pH 7.4): 2.17; (4)ACD/BCF (pH 5.5): 26.04; (5)ACD/BCF (pH 7.4): 26.04; (6)ACD/KOC (pH 5.5): 358.89; (7)ACD/KOC (pH 7.4): 358.89; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 29.96 Å2; (11)Index of Refraction: 1.497; (12)Molar Refractivity: 40.97 cm3; (13)Molar Volume: 139.7 cm3; (14)Polarizability: 16.24×10-24cm3; (15)Surface Tension: 34.8 dyne/cm; (16)Density: 1.499 g/cm3; (17)Flash Point: 107.5 °C; (18)Enthalpy of Vaporization: 49.15 kJ/mol; (19)Boiling Point: 254.1 °C at 760 mmHg; (20)Vapour Pressure: 0.0176 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1c(cnc(Cl)c1)C(F)(F)F
(2)InChI: InChI=1/C7H3ClF3NO/c8-6-1-4(3-13)5(2-12-6)7(9,10)11/h1-3H
(3)InChIKey: TUIUCTUSVSDRSW-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C7H3ClF3NO/c8-6-1-4(3-13)5(2-12-6)7(9,10)11/h1-3H
(5)Std. InChIKey: TUIUCTUSVSDRSW-UHFFFAOYSA-N

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