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3,5-Difluoropyridine-4-carboxaldehyde

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Name

3,5-Difluoropyridine-4-carboxaldehyde

EINECS N/A
CAS No. 870234-98-3 Density 1.393 g/cm3
PSA 29.96000 LogP 1.17230
Solubility N/A Melting Point 51-52oC
Formula C6H3F2NO Boiling Point 168.653 °C at 760 mmHg
Molecular Weight 143.0909 Flash Point 55.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 870234-98-3 (3,5-Difluoro-4-pyridinecarboxaldehyde) Hazard Symbols N/A
Synonyms

3,5-Difluoropyridine-4-carboxaldehyde;

 

3,5-Difluoropyridine-4-carboxaldehyde Specification

The 4-Pyridinecarboxaldehyde,3,5-difluoro-, with CAS registry number 870234-98-3, belongs to the following product categories: (1)Pharmacetical; (2)Fluorinated; (3)Organohalides; (4)Pyridine. It has the systematic name of 3,5-difluoropyridine-4-carbaldehyde. And the chemical formula of this chemical is C6H3F2NO.

Physical properties of 4-Pyridinecarboxaldehyde,3,5-difluoro-: (1)ACD/LogP: 0.04; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 29.96 Å2; (7)Index of Refraction: 1.517; (8)Molar Refractivity: 31.085 cm3; (9)Molar Volume: 102.743 cm3; (10)Polarizability: 12.323×10-24cm3; (11)Surface Tension: 41.472 dyne/cm; (12)Density: 1.393 g/cm3; (13)Flash Point: 55.8 °C; (14)Enthalpy of Vaporization: 40.509 kJ/mol; (15)Boiling Point: 168.653 °C at 760 mmHg; (16)Vapour Pressure: 1.602 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1c(F)cncc1F
(2)InChI: InChI=1/C6H3F2NO/c7-5-1-9-2-6(8)4(5)3-10/h1-3H
(3)InChIKey: RLAOKDGTZKSUJB-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C6H3F2NO/c7-5-1-9-2-6(8)4(5)3-10/h1-3H
(5)Std. InChIKey: RLAOKDGTZKSUJB-UHFFFAOYSA-N

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