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106827-26-3

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Basic Information
CAS No.: 106827-26-3
Name: 5-(2,3-Dichlorophenyl)-2-furaldehyde
Molecular Structure:
Molecular Structure of 106827-26-3 (5-(2,3-Dichlorophenyl)-2-furaldehyde)
Formula: C11H6Cl2O2
Molecular Weight: 241.073
Synonyms: 2-Furancarboxaldehyde,5-(2,3-dichlorophenyl)-;5-(2,3-Dichloro-phenyl)-furan-2-carbaldehyde;5-(2,3-dichlorophenyl)furan-2-carbaldehyde;TOS-BB-0642;
Density: 1.392 g/cm3
Boiling Point: 366 °C at 760 mmHg
Flash Point: 175.1 °C
PSA: 30.21000
LogP: 4.06590
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Specification

The 5-(2,3-Dichlorophenyl)-2-furaldehyde, with the CAS registry number 106827-26-3, is also known as 2-Furancarboxaldehyde,5-(2,3-dichlorophenyl)-. This chemical's molecular formula is C11H6Cl2O2 and molecular weight is 241.07. What's more, its systematic name is 5-(2,3-dichlorophenyl)furan-2-carbaldehyde.

Physical properties of 5-(2,3-Dichlorophenyl)-2-furaldehyde are: (1)ACD/LogP: 3.72; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 30.21 Å2; (7)Index of Refraction: 1.605; (8)Molar Refractivity: 59.68 cm3; (9)Molar Volume: 173 cm3; (10)Surface Tension: 46.2 dyne/cm; (11)Density: 1.392 g/cm3; (12)Flash Point: 175.1 °C; (13)Enthalpy of Vaporization: 61.23 kJ/mol; (14)Boiling Point: 366 °C at 760 mmHg; (15)Vapour Pressure: 1.51E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C(=C1)Cl)Cl)C2=CC=C(O2)C=O
(2)InChI: InChI=1S/C11H6Cl2O2/c12-9-3-1-2-8(11(9)13)10-5-4-7(6-14)15-10/h1-6H
(3)InChIKey: DFXHLUMKJNNXSE-UHFFFAOYSA-N