21906-36-5

Basic information

• Product Name: (4-IODOPHENYL)ACETONE
• Synonyms: (4-IODOPHENYL)ACETONE;1-(4-Iodophenyl)propan-2-one;1-(4-Iodophenyl)-2-propanone;1-(p-Iodophenyl)-2-propanone;2-Propanone, 1-(4-iodophenyl)-
• CAS NO: 21906-36-5
• Molecular Formula: C₉H₉IO
• Molecular Weight: 260.07
• Product Categories: Aromatic Ketones (substituted)
• Mol File: 21906-36-5.mol

Chemical Properties

• Boiling Point: 135-136 °C(Press: 2 Torr)
• Appearance: /
• Density: 1.646±0.06 g/cm3(Predicted)
• Storage Temp.: 2-8°C(protect from light)
• CAS DataBase Reference: (4-IODOPHENYL)ACETONE(CAS DataBase Reference)
• NIST Chemistry Reference: (4-IODOPHENYL)ACETONE(21906-36-5)
• EPA Substance Registry System: (4-IODOPHENYL)ACETONE(21906-36-5)

Safety Data

• Hazardous Substances Data: 21906-36-5(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
(4-IODOPHENYL)ACETONE is used as an organic intermediate for the synthesis of various pharmaceuticals. Its unique structure allows it to be a key component in the development of new drugs and medications, contributing to advancements in healthcare and medicine.
Used in Agrochemical Industry:
In the agrochemical sector, (4-IODOPHENYL)ACETONE serves as an essential intermediate in the production of agrochemicals. It plays a role in the synthesis of pesticides, herbicides, and other agricultural chemicals, helping to improve crop protection and yield.
Used in Organic Compounds Synthesis:
(4-IODOPHENYL)ACETONE is utilized as a starting material or intermediate in the synthesis of a wide range of organic compounds. Its reactivity and functional groups make it suitable for various chemical reactions, leading to the creation of diverse organic molecules for different applications.
Production Methods:
(4-IODOPHENYL)ACETONE can be produced through several chemical reactions, such as the Friedel-Crafts acylation of iodobenzene with acetyl chloride or by the reaction of iodobenzene with an acetyl anion. These methods allow for the efficient synthesis of the compound in laboratory and industrial settings.
Safety Precautions:

Upstream product

• 21905-93-1 4-Iod-β-nitro-propenylbenzol 
• 37051-38-0 4-Iodobenzeneacetyl chloride 
• 506-82-1 dimethylcadmium 
• 98-83-9 isopropenylbenzene 
• 15164-44-0 p-(iodophenyl)carboxaldehyde 

Downstream Products

• 21894-72-4 1-(4-iodophenyl)-propan-2-amine 
• 21906-04-7 3-(4-iodophenyl)butan-2-one 
• 74051-14-2 2-(p-Iodphenyl)-3-butylamin 
• 1268369-27-2 C₁₂H₁₃F₃INO 
• 14471-51-3 4-iodomethamphetamine hydrochloride 

Relevant articles and documents

Mass spectrometric investigations on phenylacetic acid derivatives, IV: Loss of ortho-substituents from ionized phenyl-2-propanones upon electron impact

In the gas phase, the phenyl-2-propanone molecules 2a-4a lose upon electron impact chloro-, bromo-, and iodo-radicals specifically at the orthopOsition of the phenyl group giving rise to strong (M-Hal.)+-ions (70/12 eV; 1st and 2nd FFR) of identical structure as confirmed by their MIKE-CAD-spectra. The daughter ions at m/z 133 from o-chlorophenyl-2-propanone (2a) and 2,2-dimethyl-2,3-dihydro[b]furane (11) are structurally similar but not identical (similarity index 99.8). The collisionally activated (2nd FFR) (M-Br.)+-ions from o-bromophenyl-2-propanone (3a) and 1-bromo-1-phenyl-2-propanone (12) produce virtually congruent spectra. The most impOrtant subsequent fragmentation of the (M-Hal-)+-ions from 2a-4a is the loss of CO which incorporates the C-atom of the carbonyl group exclusively (13C labelling). Mechanistic aspects of the fragmentation sequences are discussed (Figs. 5 and 8).