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532967-21-8

Basic Information
CAS No.: 532967-21-8
Name: 2,6-DIFLUORO-4-HYDROXYBENZALDEHYDE
Article Data: 2
Molecular Structure:
Molecular Structure of 532967-21-8 (2,6-DIFLUORO-4-HYDROXYBENZALDEHYDE)
Formula: C7H4F2O2
Molecular Weight: 158.104
Synonyms: 2,6-Difluoro-4-hydroxybenzaldehyde;2,6-Difluor-4-hydroxybenzaldehyd;
Density: 1.464 g/cm3
Melting Point: 179-182℃
Boiling Point: 252.6 °C at 760 mmHg
Flash Point: 106.5 °C
Hazard Symbols: IrritantXi
Risk Codes: 20-36/37/38
Safety: 22-36/37/39-45
PSA: 37.30000
LogP: 1.48290
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    2,6-Difluoro-4-hydroxybenzaldehyde

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Specification

The 2,6-Difluoro-4-hydroxybenzaldehyde with the CAS number 532967-21-8 is also called Benzaldehyde,2,6-difluoro-4-hydroxy-. Its molecular formula is C7H4F2O2. This chemical belongs to the following product categories: (1)Aldehyde; (2)Alcohol; (3)Halide; (4)Aromatic Aldehydes & Derivatives (substituted). It is irritant. While using this chemical, you should be very cautious.

The properties of the 2,6-Difluoro-4-hydroxybenzaldehyde are: (1)ACD/LogP: 2.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.34; (4)ACD/LogD (pH 7.4): 0.92 ; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 37.3 Å2; (9)Index of Refraction: 1.559; (10)Molar Refractivity: 34.87 cm3; (11)Molar Volume: 107.9 cm3; (12)Polarizability: 13.82×10-24cm3; (13)Surface Tension: 46.3 dyne/cm; (14)Enthalpy of Vaporization: 50.97 kJ/mol; (15)Vapour Pressure: 0.0121 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(O)cc(F)c1C=O
(2)InChI: InChI=1/C7H4F2O2/c8-6-1-4(11)2-7(9)5(6)3-10/h1-3,11H
(3)InChIKey: ROAQMGJHSNIROA-UHFFFAOYAG