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4-Bromobenzaldehyde

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CAS:1122-91-4
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4-Bromobenzaldehyde Basic information
Product Name:4-Bromobenzaldehyde
Synonyms:4-Brombenzaldehyd;4-bromo-benzaldehyd;Benzaldehyde, p-bromo-;Benzaldehyde,4-bromo-;p-bromo-benzaldehyd;AKOS BBS-00003194;4-BROMOBENZYLALDEHYDE;4-BROMOBENZALDEHYDE
CAS:1122-91-4
MF:C7H5BrO
MW:185.02
EINECS:214-365-0
Product Categories:Pyridines ,Indolines ,Indoles;Aldehydes;C7;Carbonyl Compounds;FINE Chemical & INTERMEDIATES;Aromatic Aldehydes & Derivatives (substituted);Benzaldehyde;Benzaldehyde (Building Blocks for Liquid Crystals);Bifunctional Compounds (Building Blocks for Liquid Crystals);Building Blocks for Liquid Crystals;Functional Materials;1122-91-4;bc0001
Mol File:1122-91-4.mol
4-Bromobenzaldehyde Structure
4-Bromobenzaldehyde Chemical Properties
Melting point 55-58 °C(lit.)
Boiling point 66-68°C 2mm
bulk density670kg/m3
density 1.85 g/cm3
refractive index 1.5727 (estimate)
Fp 228 °F
storage temp. Store below +30°C.
solubility Chloroform, Ethyl Acetate
form Crystalline Solid
color White
Water Solubility INSOLUBLE
Sensitive Air Sensitive
BRN 507100
InChI1S/C7H5BrO/c8-7-3-1-6(5-9)2-4-7/h1-5H
InChIKeyZRYZBQLXDKPBDU-UHFFFAOYSA-N
SMILES[H]C(=O)c1ccc(Br)cc1
LogP2.75 at 25℃
CAS DataBase Reference1122-91-4(CAS DataBase Reference)
NIST Chemistry ReferenceBenzaldehyde, 4-bromo-(1122-91-4)
EPA Substance Registry SystemBenzaldehyde, 4-bromo- (1122-91-4)
Safety Information
Hazard Codes Xn,Xi
Risk Statements 22-36/37/38-43
Safety Statements 26-36/37-36/37/39-22
RIDADR 2811
WGK Germany 2
RTECS CU4810000
Hazard Note Irritant/Harmful/Air Sensitive
TSCA TSCA listed
HazardClass 6.1(b)
PackingGroup III
HS Code 29130000
Storage Class11 - Combustible Solids
Hazard ClassificationsAcute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1
STOT SE 3
MSDS Information
ProviderLanguage
4-Bromobenzaldehyde English
ACROS English
SigmaAldrich English
ALFA English
4-Bromobenzaldehyde Usage And Synthesis
Chemical Propertieswhite crystalline solid
UsesEmployed in palladium-catalyzed mono- and bis-arylation of 3,4-(ethylenedioxy)thiophenes. Also used in a cross-coupling study with potassium vinyltrifluoroborate.
Uses4-Bromobenzaldehyde is widely utilized as an intermediate for the preparation of agrochemicals, pharmaceuticals and other organic compounds. It is used as a precursor and reacts with sulfamethoxazole to prepare Schiffs base, 4-[(4-Bromo-benzylidene)-amino]-N-(5-methyl-isoxazol-3-yl)-benzene sulfonamide, which can be used for the photo stability of polyvinyl chloride (PVC). It plays an important role in palladium-catalyzed mono- and bis-arylation of 3,4-(ethylenedioxy)thiophenes. It is employed in a cross-coupling study with potassium vinyltrifluoroborate.
Reactions 4-Bromobenzaldehyde is widely utilized as an intermediate for preparing agrochemicals, pharmaceuticals, and other organic compounds. It is used as a precursor and reacts with sulfamethoxazole to prepare Schiffs base, 4-[(4-Bromo-benzylidene)-amino]-N-(5-methyl-isoxazol-3-yl)-benzene sulfonamide, which can be used for the photostability of polyvinyl chloride (PVC). It plays a vital role in palladium-catalyzed mono- and bis-arylation of 3,4-(ethylenedioxy)thiophenes. It is employed in a cross-coupling study with potassium vinyltrifluoroborate.
Synthesis Reference(s)Journal of the American Chemical Society, 81, p. 4113, 1959 DOI: 10.1021/ja01524a080
Tetrahedron Letters, 21, p. 813, 1980 DOI: 10.1016/S0040-4039(00)71512-7
Preparation 4-Bromobenzaldehyde is prepared by 2-Iodoxy-5-Methylbenzenesulfonic Acid-Catalyzed Selective Oxidation of 4-Bromobenzyl Alcohol.
Tag:4-Bromobenzaldehyde(1122-91-4) Related Product Information
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