159217-89-7

Basic information

• Product Name: TERT-BUTYL N-(4-IODOPHENYL)CARBAMATE
• Synonyms: N-BOC-4-IODOANILINE;TERT-BUTYL 4-IODOPHENYLCARBAMATE;TERT-BUTYL N-(4-IODOPHENYL)CARBAMATE;N-(tert-Butoxycarbonyl)-4-iodoaniline;(4-Iodophenyl)carbamic acid tert-butyl ester
• CAS NO: 159217-89-7
• Molecular Formula: C₁₁H₁₄INO₂
• Molecular Weight: 319.14
• Mol File: 159217-89-7.mol
• Article Data: 37

Chemical Properties

• Melting Point: 146-147°C
• Boiling Point: 299°Cat760mmHg
• Flash Point: 134.6°C
• Appearance: /
• Density: 1.591g/cm³
• Vapor Pressure: 0.00123mmHg at 25°C
• Refractive Index: 1.604
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• PKA: 13.12±0.70(Predicted)
• Sensitive: Light Sensitive
• CAS DataBase Reference: TERT-BUTYL N-(4-IODOPHENYL)CARBAMATE(CAS DataBase Reference)
• NIST Chemistry Reference: TERT-BUTYL N-(4-IODOPHENYL)CARBAMATE(159217-89-7)
• EPA Substance Registry System: TERT-BUTYL N-(4-IODOPHENYL)CARBAMATE(159217-89-7)

Safety Data

• Hazard Codes: Xn,N
• Statements: 22-43-50
• Safety Statements: 36/37-61
• RIDADR: UN 3077 9 / PGIII
• WGK Germany: 3
• Hazardous Substances Data: 159217-89-7(Hazardous Substances Data)

Usage

General Description

Tert-Butyl N-(4-iodophenyl)carbamate is a chemical compound with the molecular formula C12H15INO2. It is classified as a carbamate, which is a type of ester derived from carbamic acid. TERT-BUTYL N-(4-IODOPHENYL)CARBAMATE is commonly used as a reagent in organic synthesis, particularly in the preparation of pharmaceuticals and agrochemicals. It is also used as a precursor in the synthesis of biologically active molecules and pharmacologically important compounds. Tert-butyl N-(4-iodophenyl)carbamate is known for its ability to modify the biological activity of various substances, making it a valuable tool in drug discovery and development. Due to its potential impact on human health and the environment, it is important to handle and use this compound with care, following appropriate safety measures and guidelines.

InChI:InChI=1/C11H14INO2/c1-11(2,3)15-10(14)13-9-6-4-8(12)5-7-9/h4-7H,1-3H3,(H,13,14)

Upstream product

• 24424-99-5 di-tert-butyl dicarbonate 
• 540-37-4 p-aminoiodobenzene 
• 34619-03-9 tert-butyldicarbonate 
• 3422-01-3 tert-butyl phenylcarbamate 
• 74367-81-0 4-iodoaniline hydrochloride 
• 106-50-3 1,4-phenylenediamine 
• 71026-66-9 N-(tert-butoxycarbonyl)-1,4-phenylenediamine 
• 1093102-82-9 4-((tert-butoxycarbonyl)amino)phenyl trifluoromethanesulfonate 

Downstream Products

• 628293-28-7 (S)-N-4-iodophenyl-N'-(1-methyl-2-hydroxy)ethylurea 
• 628293-20-9 (R)-N-4-iodophenyl-N'-(1-methyl-2-hydroxy)ethylurea 
• 317842-68-5 N-tert-butoxycarbonyl-4-(trimethylsilylethynyl)aniline 
• 224635-57-8 ⁽³⁾-[4-(tert-Butoxycarbonylamino)phenyl]-propenoic acid methyl ester 
• 947171-33-7 (4-(N-tert-butoxycarbonyl-amino)phenyl)phosphinic acid ethyl ester 
• 947171-04-2 (4-(N-tert-butoxycarbonyl-amino)phenyl)phosphinic acid methyl ester 
• 947171-02-0 (4-(N-tert-butoxycarbonyl-amino)phenyl)phosphinic acid 
• 947171-07-5 2-[((4-(N-tert-butoxycarbonyl-amino)-phenyl)(methoxy)-phosphinoyl)-methyl]pentane-1,5-dioic acid dimethyl ester 
• 945413-20-7 1-oxo-1-[5-(2-pyridyl)oxazol-2-yl]-7-(4-(tert-butyloxycarbonyl)aminophenyl)-heptane 
• 65198-02-9 3-(4-aminophenyl)-acrylic acid methyl ester 
• 241499-52-5 4-(3,3-dimethyl-butyl)-phenylamine 
• 241499-51-4 [4-(3,3-dimethyl-butyl)-phenyl]-carbamic acid tert-butyl ester 

Relevant articles and documents

Efficient and eco-friendly synthesis of iodinated aromatic building blocks promoted by iodine and hydrogen peroxide in water: A mechanistic investigation by mass spectrometry

The reaction of aromatic and heteroaromatic compounds with molecular iodine in the presence of aqueous hydrogen peroxide using water without any co-solvent at 50 °C for 24 h produced versatile iodinated organic molecules with potential application in organic synthesis and medicine in very good yields. In addition, a mechanistic investigation for the iodination process was carried out by mass spectrometry.

Base-Mediated Generation of Ketenimines from Ynamides: [3+2] Annulation with Azaallyl Anions

Under basic conditions and heat, ynamides can serve as precursors to ketenimines, whose synthetic potential is often hampered by their difficulty of access. Herein, we report that they can undergo a [3+2] cycloaddition with 2-azaallyl anions, obtained from benzylimines under the same reaction conditions. This reaction between two highly reactive intermediates, both generated in situ from bench stable starting materials, gives access to various nitrogen-rich heterocycles. The reaction usually proceeds with excellent diastereoselectivity, in favor of the cis adduct. Deuteration experiments and DFT calculations helped rationalize the regio- and stereoselectivity of the process as well as the formation of side products. (Figure presented.).

Mild deprotection of the: N-tert -butyloxycarbonyl (N -Boc) group using oxalyl chloride

We report a mild method for the selective deprotection of the N-Boc group from a structurally diverse set of compounds, encompassing aliphatic, aromatic, and heterocyclic substrates by using oxalyl chloride in methanol. The reactions take place under room temperature conditions for 1-4 h with yields up to 90percent. This mild procedure was applied to a hybrid, medicinally active compound FC1, which is a novel dual inhibitor of IDO1 and DNA Pol gamma. A broader mechanism involving the electrophilic character of oxalyl chloride is postulated for this deprotection strategy. This journal is