108468-00-4

Basic information

• Product Name: 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene
• Synonyms: (3-AMINOMETHYL-BENZYL)-CARBAMIC ACID TERT-BUTYL ESTER;1-(N-BOC-AMINOMETHYL)-3-(AMINOMETHYL)BENZENE;Carbamicacid,[[4-(aminomethyl)phenyl]methyl]-1,1-dimethylethylester;1-(N-BOC-AMINOMETHYL)-4-(AMINOMETHYL) BE;tert-Butyl 4-(Aminomethyl)benzylcarbamate;1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene;tert-Butyl N-[4-(aminomethyl)benzyl]carbamate;3-(3-methoxyphenyl)-1-[2-(4-nitrophenyl)ethyl]-3-propylpyrrolidine hydrochloride
• CAS NO: 108468-00-4
• Molecular Formula: C₁₃H₂₀N₂O₂
• Molecular Weight: 236.31
• Product Categories: Benzene series;Aminomethyl's;Phenyls & Phenyl-Het;Nitrogen Compounds;Organic Building Blocks;Protected Amines
• Mol File: 108468-00-4.mol
• Article Data: 27

Chemical Properties

• Melting Point: 64-68 °C(lit.)
• Boiling Point: 250 °C(lit.)
• Flash Point: >230 °F
• Appearance: White to slightly yellow-pink or beige/Powder
• Density: 1.06 g/mL at 25 °C(lit.)
• Vapor Pressure: 4.01E-06mmHg at 25°C
• Refractive Index: n20/D 1.523(lit.)
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• PKA: 12.29±0.46(Predicted)
• CAS DataBase Reference: 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene(108468-00-4)
• EPA Substance Registry System: 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene(108468-00-4)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36
• WGK Germany: 3
• Hazardous Substances Data: 108468-00-4(Hazardous Substances Data)

Usage

Description

1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene is a protected amine derivative, characterized by the presence of a Boc-protected aminomethyl group at the 1-position and an unprotected aminomethyl group at the 4-position of the benzene ring. 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene is significant in organic synthesis and chemical research due to its unique structural features and reactivity.

Uses

Used in Chemical Synthesis:
1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene is used as a key intermediate for the synthesis of various complex organic molecules and compounds. Its Boc-protected amine group allows for selective reactions at the 4-position, while the unprotected amine group can be utilized for further functionalization.
Used in Oligomeric Thiourea Synthesis:
In the field of supramolecular chemistry, 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene is used as a building block for the synthesis of oligomeric thioureas. These oligomeric thioureas have potential applications in the development of new materials with unique properties, such as self-assembly and molecular recognition.
Used in Bipyrrole-based [2]Catenane Synthesis:
1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene is also employed in the synthesis of bipyrrole-based [2]catenanes, which are interlocked molecular structures with potential applications in molecular machines, sensors, and drug delivery systems.
Used in Model Receptor Synthesis for Dicationic Guests:
1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene serves as a starting material for the development of model receptors designed to selectively bind dicarboxylates and monosaccharides. These model receptors can be used in the study of molecular recognition and have potential applications in the design of new catalysts and sensors.
Used in Model Receptor Synthesis for Monosaccharides:
Similarly, 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene is used in the synthesis of model receptors for monosaccharides, which can be employed in the study of carbohydrate recognition and interactions, as well as in the development of new drugs and diagnostic tools.

InChI:InChI=1/C13H20N2O2/c1-13(2,3)17-12(16)15-9-11-6-4-10(8-14)5-7-11/h4-7H,8-9,14H2,1-3H3,(H,15,16)

Upstream product

• 24424-99-5 di-tert-butyl dicarbonate 
• 539-48-0 p-xylylidenediamine 
• 66389-80-8 tert-butyl N-[(4-cyanophenyl)methyl]carbamate 
• 10406-25-4 4-aminobenzyl cyanide 
• 84466-87-5 4-(azidomethyl)benzonitrile 
• 17201-43-3 4-cyanobenzyl bromide 
• 35975-12-3 3,6-dimethylbenzene-1,2-diamine 
• 6627-89-0 tert-butyl phenyl carbonate 
• 1257585-74-2 tert-butyl (4-(acetamidomethyl)benzyl)carbamate 

Downstream Products

• 184954-76-5 1,1-dimethylethyl N-(4-(isothiocyanatomethyl)phenylmethyl)carbamate 
• 329771-57-5 1,3-bis[3-[4-(tert-butoxycarbonylaminomethyl)benzyl]thioureidomethyl]benzene 
• 345293-86-9 N-[(p-carboxyphenyl)methyl]-N'-[(p-(N-t-BOC-aminomethyl)phenyl)methyl]-1,4,5,8-naphthalenetetracarboxylic diimide 
• 329771-58-6 1,3-bis[3-[4-(aminomethyl)benzyl]thioureidomethyl]benzene 
• 174960-09-9 4-[(4-{[(tert-Butoxycarbonyl)amino]methyl}benzyl)amino]-4-oxobutanoic acid 
• 723284-13-7 tert-butyl {4-[(7-bromo-3-nitroquinolin-4-ylamino)methyl]benzyl}carbamate 
• 808761-55-9 (4-{[(imidazole-1-carbonyl)-amino]-methyl}-benzyl)-carbamic acid tert-butyl ester 
• 864176-48-7 tert-Butyl (4-{[(4-ethoxybenzoyl)amino]methyl}benzyl)carbamate 
• 864176-46-5 tert-Butyl (4-{[(4-phenoxybenzoyl)amino]methyl}benzyl)carbamate 
• 330595-60-3 1,4-bis-(4-N-tert-butoxycarbonylaminomethylbenzylaminocarbonylmethyl-1-oxyprop-2-ynyl)benzene 
• 330595-61-4 1,3-bis-(4-N-tert-butoxycarbonylaminomethylbenzylaminocarbonylmethyl-1-oxyprop-2-ynyl)benzene 
• 330595-56-7 1,3-bis-(4-N-tert-butoxycarbonylaminomethylbenzylaminocarbonyl-1-oxyprop-2-ynyl)-benzene 
• 330595-57-8 1,2-bis-(4-N-tert-butoxycarbonylaminomethylbenzylaminocarbonyl-1-oxyprop-2-ynyl)-benzene 
• 330595-54-5 3,4-bis-(4-N-tert-butoxycarbonylaminomethylbenzylaminocarbonyl-1-oxyprop-2-ynyl)-thiophene 

Relevant articles and documents

Benzazepine Dicarboxamide Compounds

This invention relates to novel benzazepine dicarboxamide compounds of the formula wherein R1 to R4 are as defined in the description and in the claims, as well as pharmaceutically acceptable salts thereof. These compounds are TLR agonists and may therefore be useful as medicaments for the treatment of diseases such as cancer, autoimmune diseases, inflammation, sepsis, allergy, asthma, graft rejection, graft-versus-host disease, immunodeficiencies, and infectious diseases.

CATIONIC BIS-UREA COMPOUNDS AS EFFECTIVE ANTIMICROBIAL AGENTS

A cationic bis-urea compound is disclosed of formula (1): wherein: each m is independently an integer of 0 to 4,each k is independently 0 or 1,each Z′ is a monovalent radical independently selected from the group consisting of hydroxyl (*—OH), carboxyl (*—COOH), cyano (*—CN), nitro (*—NO2), sulfonate (*—SO3?), trifluoromethyl (*—CF3), halides, amine groups, ketone groups, alkyl groups comprising 1 to 6 carbons, alkoxy groups comprising 1 to 6 carbons, thioether groups comprising 1 to 6 carbons, and combinations thereof,each L′ is independently a divalent alkylene group comprising 1 to 6 carbons, wherein a *-[-L′-]k- is a single bond when k is 0,each Y′ is independently a monovalent non-polymeric radical comprising a positive charged amine, andeach X′ is independently a negative charged counterion.

Covalent modification of glassy carbon surface with organic redox probes through diamine linkers using electrochemical and solid-phase synthesis methodologies

Various mono-Boc-protected diamines have been covalently grafted to glassy carbon electrodes by electrochemical oxidation of the free amine. After deprotection of the Boc group, anthraquinone and nitrobenzene probes were coupled to the linkers using solid-phase coupling reactions. X-Ray photoelectron spectroscopy and cyclic voltammetry were used to monitor the coupling efficiency, effect of linker length on the surface coverage and electron transfer between the attached redox probes and electrode. The anthraquinone surface coverage was found to decrease as the chain length of alkyl diamine linker increased and the electron transfer kinetics were found to be faster for the lower coverages and the longer, more flexible linkers. In the case of nitrobenzene, there was only a slightly change in coverage with increasing linker length. This electrochemical attachment of protected diamine linkers followed by solid-phase coupling provides a very versatile methodology for attaching a wide range of molecular architectures onto glassy carbon surfaces. The Royal Society of Chemistry 2008.