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6455-94-3

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Basic Information
CAS No.: 6455-94-3
Name: 2-(3-FLUORO-BENZYLOXY)-BENZALDEHYDE
Molecular Structure:
Molecular Structure of 6455-94-3 (2-(3-FLUORO-BENZYLOXY)-BENZALDEHYDE)
Formula: C14H11FO2
Molecular Weight: 230.23
Synonyms: ZINC00453669;STK198730;
Density: 1.211 g/cm3
Boiling Point: 356.6 °C at 760 mmHg
Flash Point: 163.7 °C
Hazard Symbols: IrritantXi
PSA: 26.30000
LogP: 3.21720
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Specification

The 2-[(3-Fluorophenyl)methoxy]benzaldehyde, with the CAS registry number 6455-94-3, is also known as Benzaldehyde, 2-[(3-fluorophenyl)methoxy]-. This chemical's molecular formula is C14H11FO2 and molecular weight is 230.2343. Its IUPAC name is called 2-[(3-fluorophenyl)methoxy]benzaldehyde. When you are using this chemical, please be cautious about it, it may cause inflammation to the skin or other mucous membranes. 

Physical properties of 2-[(3-Fluorophenyl)methoxy]benzaldehyde: (1)ACD/LogP: 3.42; (2)#H bond acceptors: 2; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 4; (5)Index of Refraction: 1.59; (6)Molar Refractivity: 64.16 cm3; (7)Molar Volume: 190 cm3; (8)Surface Tension: 43.6 dyne/cm; (9)Density: 1.211 g/cm3; (10)Flash Point: 163.7 °C; (11)Enthalpy of Vaporization: 60.18 kJ/mol; (12)Boiling Point: 356.6 °C at 760 mmHg; (13)Vapour Pressure: 2.9E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C(=C1)C=O)OCC2=CC(=CC=C2)F
(2)InChI: InChI=1S/C14H11FO2/c15-13-6-3-4-11(8-13)10-17-14-7-2-1-5-12(14)9-16/h1-9H,10H2
(3)InChIKey: BSAJRFAEOQFFKC-UHFFFAOYSA-N