5-PHENYL-2-FURALDEHYDE

The 2-Furancarboxaldehyde,5-phenyl-, with CAS registry number 13803-39-9, belongs to the following product categories: (1)API intermediates; (2)Building Blocks; (3)Furans; (4)Heterocyclic Building Blocks. It has the systematic name of 5-phenylfuran-2-carbaldehyde. And the chemical formula of this chemical is C₁₁H₈O₂.

Physical properties of 2-Furancarboxaldehyde,5-phenyl-: (1)ACD/LogP: 2.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.8; (4)ACD/LogD (pH 7.4): 2.8; (5)ACD/BCF (pH 5.5): 79.03; (6)ACD/BCF (pH 7.4): 79.03; (7)ACD/KOC (pH 5.5): 794.4; (8)ACD/KOC (pH 7.4): 794.4; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 30.21 Å²; (13)Index of Refraction: 1.583; (14)Molar Refractivity: 49.89 cm³; (15)Molar Volume: 149.1 cm³; (16)Polarizability: 19.78×10^-24cm³; (17)Surface Tension: 41.9 dyne/cm; (18)Density: 1.154 g/cm³; (19)Flash Point: 104.8 °C; (20)Enthalpy of Vaporization: 56.43 kJ/mol; (21)Boiling Point: 322.5 °C at 760 mmHg; (22)Vapour Pressure: 0.000279 mmHg at 25°C.

Preparation: this chemical can be prepared by furfural and benzenediazonium; chloride. This reaction will need reagent CuCl₂^.2H₂O and solvents acetone, H₂O. The reaction temperature is 15 - 18 ℃. The yield is about 50%.

Uses of 2-Furancarboxaldehyde,5-phenyl-: it can be used to produce 5-phenyl-furan-2-carboxylic acid. This reaction will need reagents aq. NaOH solution, silver oxide.

When you are using this chemical, please be cautious about it as the following:
The 2-Furancarboxaldehyde,5-phenyl- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2oc(c1ccccc1)cc2
(2)InChI: InChI=1/C11H8O2/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-8H
(3)InChIKey: BMJHNNPEPBZULA-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C11H8O2/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-8H
(5)Std. InChIKey: BMJHNNPEPBZULA-UHFFFAOYSA-N