3-Phenoxybenzaldehyde CAS 39515-51-0
Introduction：Basic information about 3-Phenoxybenzaldehyde CAS 39515-51-0, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
3-Phenoxybenzaldehyde Basic information
| Product Name: | 3-Phenoxybenzaldehyde |
| Synonyms: | M-PHENOXY BENZALDEHYDE;3-phenoxy-benzaldehyd;3-PHENOXYBENZALDEHYDE;3-FORMYLDIPHENYL ETHER;AKOS BBS-00003181;m-Phenoxybenzaldehyde 3-Phenoxybenzaldehyde;Benzaldehyde,3-phenoxy-;m-(phenyloxy)benzaldehyde |
| CAS: | 39515-51-0 |
| MF: | C13H10O2 |
| MW: | 198.22 |
| EINECS: | 254-487-1 |
| Product Categories: | Aromatics;Intermediates & Fine Chemicals;Pharmaceuticals;Aromatic Aldehydes & Derivatives (substituted);Aldehydes;C10 to C21;Carbonyl Compounds;Pesticide intermediate;Building Blocks;C13-C60;Carbonyl Compounds;Chemical Synthesis;Organic Building Blocks |
| Mol File: | 39515-51-0.mol |
3-Phenoxybenzaldehyde Chemical Properties
| Melting point | 13 °C |
| Boiling point | 169-169.5 °C11 mm Hg(lit.) |
| density | 1.147 g/mL at 25 °C(lit.) |
| refractive index | n |
| Fp | >230 °F |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | Chloroform, Dichloromethane (Slightly), Methanol (Slightly) |
| form | Oil |
| color | Colourless to Pale Yellow |
| Sensitive | Air Sensitive |
| BRN | 511662 |
| InChI | InChI=1S/C13H10O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-10H |
| InChIKey | MRLGCTNJRREZHZ-UHFFFAOYSA-N |
| SMILES | C(=O)C1=CC=CC(OC2=CC=CC=C2)=C1 |
| CAS DataBase Reference | 39515-51-0(CAS DataBase Reference) |
| EPA Substance Registry System | Benzaldehyde, 3-phenoxy- (39515-51-0) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 22-26 |
| Safety Statements | 23-24/25-45-38-28 |
| RIDADR | UN2810 - class 6.1 - PG 3 - EHS - Toxic, liquids, organic, n.o.s., HI: all |
| WGK Germany | 3 |
| RTECS | CU7560200 |
| TSCA | TSCA listed |
| HazardClass | 6.1 |
| PackingGroup | II |
| HS Code | 29124900 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 4 Oral Aquatic Acute 1 Aquatic Chronic 1 |
| Toxicity | LD ipr-mus: >500 mg/kg JAFCAU26,954,78 |
| Chemical Properties | clear light yellow to amber liquid, insoluble in water, soluble in alcohol, benzene, toluene and other organic solvents. |
| Uses | 3-phenoxybenzaldehyde is an important intermediate for the synthesis of pyrethroid pesticides phenothrin, cypermethrin, deltamethrin,fenvalerate, fenpropathrin, flucythrinate, cyhalothrin, etc. |
| Preparation | Synthesis of 3-Phenoxybenzaldehyde: 3-phenoxybenzoic acid is generated by catalytic oxidation of 3-phenoxytoluene, followed by electrolytic reduction to obtain Phenoxybenzyl alcohol , and then selective oxidation with sodium hypochlorite to obtain 3-Phenoxybenzaldehyde. |
| Production Methods | 3-Phenoxybenzaldehyde is prepared by adding, at a relatively low temperature, a mixture of a 3-phenoxybenzyl halide and a 3-phenoxybenzal halide to a mixture of hexamethylenetetramine, acetic acid and water, the amounts of the water and acid bearing certain relationships to the amount of the mixture of halides, then heating the resulting mixture to a specified temperature level and maintaining it at that level for a specified period of time. https://patents.google.com/patent/US4229380A/en |
| General Description | Enantioselective autoinduction during asymmetric hydrocyanation of 3-phenoxybenzaldehyde catalyzed by cyclo[(R)-phenylalanyl-(R)-histidyl] has been investigated. It undergoes hydrogenation catalyzed by Au/Pt bimetallic core/shell nanoparticles to yield 3-phenoxyphenyl methanol. |
| Safety Profile | Moderately toxic by intraperitoneal route. When heated to decomposition it emits acrid smoke and irritating vapors. |
| Degradation | 3-Phenoxybenzoic acid(3-PBA) and 3-phenoxybenzaldehyde are the most common intermediates in the degradation pathways of Type Il pyrethroids by bacteria, except the cyfluthrin degradation in Brevibacterium aureum DG-12, the beta-cyfluthrin degradation in Pseudomonas stutzeri S1, and the fenpropathrin degradation in Clostridium sp. ZP3(Chen et al.2013a; Saikia et al.2005;Zhang et al.2011b). |
3-Phenoxybenzaldehyde Preparation Products And Raw materials
| Raw materials | Nitric acid-->Chlorine-->Carbon tetrachloride-->Copper(I) chloride-->Benzyl chloride-->Hexamethylenetetramine-->Bromobenzene-->Diphenyl ether-->Sodium chlorate-->ABIN-->m-Cresol-->Benzyl alcohol-->Cobalt chloride-->BENZAL CHLORIDE-->3-PHENOXYTOLUENE-->3-Bromobenzaldehyde-->3-Phenoxybenzoic acid-->N-VINYLACETAMIDE 97 |
| Preparation Products | Fenvalerate-->3-Phenoxybenzyl alcohol-->Deltamethrin-->Fenpropathrin-->Cypermethrin-->λ-Cyhalothrin-->Esfenvalerate-->CYCLOPROTHRIN-->3-PHENOXYBENZALDEHYDE CYANOHYDRIN-->VALERATE-->alpha-Cypermethrin-->brofluthrinate-->3-(4-Bromophenoxy)Benzaldehyde |
