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1-Bromo-4-(1,3-dioxolan-2-ylmethyl)benzene is an organic chemical compound with the molecular formula C10H11BrO2. It features a benzene ring with a bromine atom attached at the 1st position and a 1,3-dioxolan-2-ylmethyl group attached at the 4th position. The 1,3-dioxolan-2-ylmethyl group consists of a 1,3-dioxolane ring with a methylene bridge (-CH2-) connecting the ring to the benzene. 1-BROMO-4-(1,3-DIOXOLAN-2-YLMETHYL)BENZENE is often used as an intermediate in the synthesis of various pharmaceuticals and agrochemicals due to its unique structure and reactivity. It is typically synthesized through bromination of 4-(1,3-dioxolan-2-ylmethyl)benzene or through other related chemical reactions. The compound is a colorless liquid with a pungent odor and is sensitive to light and heat, requiring proper storage conditions to maintain its stability.

4410-16-6

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4410-16-6 Usage

Explanation

The molecular formula represents the number of atoms of each element present in a molecule. In this case, the compound has 9 carbon (C), 9 hydrogen (H), 1 bromine (Br), and 2 oxygen (O) atoms.

Explanation

The structure describes the arrangement of atoms in the molecule. It consists of a benzene ring with a bromine atom at the 1st position and a dioxolane group attached to the 4th position.
3. Brominated Organic Compound

Explanation

The presence of a bromine atom in the molecule classifies it as a brominated organic compound, which means it has a bromine atom covalently bonded to a carbon atom.
4. Benzene Ring

Explanation

The compound contains a benzene ring, which is a six-membered carbon ring with alternating single and double bonds between the carbon atoms.
5. Dioxolane Group

Explanation

The dioxolane group is a five-membered ring containing two oxygen atoms and three carbon atoms. In 1-BROMO-4-(1,3-DIOXOLAN-2-YLMETHYL)BENZENE, the dioxolane group is attached to the benzene ring through a methylene (-CH2-) bridge.

Explanation

The compound is used as a building block in the synthesis of various compounds, making it valuable in the fields of organic chemistry and pharmaceutical research.

Explanation

Due to its reactivity, 1-bromo-4-(1,3-dioxolan-2-ylmethyl)benzene can be used to create a wide range of specialty chemicals and pharmaceutical intermediates, which are essential for the development of new drugs and other chemical products.

Explanation

The compound is known for its reactivity, which allows it to participate in different chemical reactions to produce new compounds with different properties and applications.

Structure

1-Bromo-4-(1,3-dioxolan-2-ylmethyl)benzene

Applications

Organic synthesis and pharmaceutical research

Building Block

Synthesis of specialty chemicals and pharmaceutical intermediates

Reactivity

Capable of undergoing various chemical reactions

Check Digit Verification of cas no

The CAS Registry Mumber 4410-16-6 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,4,1 and 0 respectively; the second part has 2 digits, 1 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 4410-16:
(6*4)+(5*4)+(4*1)+(3*0)+(2*1)+(1*6)=56
56 % 10 = 6
So 4410-16-6 is a valid CAS Registry Number.
InChI:InChI=1/C10H11BrO2/c11-9-3-1-8(2-4-9)7-10-12-5-6-13-10/h1-4,10H,5-7H2

4410-16-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-[(4-bromophenyl)methyl]-1,3-dioxolane

1.2 Other means of identification

Product number -
Other names 1-Bromo-4-(1,3-dioxolan-2-ylmethyl)benzene

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:4410-16-6 SDS

4410-16-6Relevant academic research and scientific papers

Combining neurobehavioral analysis and in vivo photoaffinity labeling to understand protein targets of methamphetamine in Casper zebrafish

Tackie-Yarboi, Ethel,Wisner, Alexander,Horton, Austin,Chau, Tue Q. T.,Reigle, James,Funk, Adam J.,McCullumsmith, Robert E.,Hall, Frank S.,Williams, Frederick E.,Schiefer, Isaac T.

, p. 2761 - 2773 (2020)

Photoaffinity labeling (PAL) remains one of the most widely utilized methods of determining protein targets of drugs. Although useful, the scope of this technique has been limited to in vitro applications because of the inability of UV light to penetrate whole organisms. Herein, pigment-free Casper zebrafish were employed to allow in vivo PAL. A methamphetamine-related phenethylamine PAL probe, designated here as 2, demonstrated dose-dependent effects on behavior similar to methamphetamine and permitted concentration-dependent labeling of protein binding partners. Click chemistry was used to analyze binding partners via fluoroimaging. Conjugation to a biotin permitted streptavidin pull-down and proteomic analysis to define direct binding partners of the methamphetamine probe. Bioinformatic analysis revealed the probe was chiefly bound to proteins involved in phagocytosis and mitochondrial function. Future applications of this experimental paradigm combining examination of drug-protein binding interactions alongside neurobehavioral readouts via in vivo PAL will significantly enhance our understanding of drug targets, mechanism(s) of action, and toxicity/lethality.

Iodine-catalyzed tandem synthesis of terminal acetals and glycol mono esters from olefins

Kumar, Macharla Arun,Swamy, Peraka,Naresh, Mameda,Reddy, Marri Mahender,Rohitha, Chozhiyath Nappunni,Prabhakar, Sripadi,Sarma, Akella Venkata Subrahmanya,Kumar, Joseph Richard Prem,Narender, Nama

supporting information, p. 1711 - 1713 (2013/03/14)

A new metal-free protocol is described for the synthesis of terminal acetals by tandem oxidative rearrangement of olefins using oxone as an oxidant in the presence of iodine. Moreover, a one-pot procedure for the preparation of glycol mono esters from olefins is also presented for the first time using the same reagent system. The Royal Society of Chemistry 2013.

COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY

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Page/Page column 104; 105, (2013/02/27)

The present invention relates to compounds acting both as muscarinic receptor antagonists and beta2 adrenergic receptor agonists, to processes for their preparation, to compositions comprising them, to therapeutic uses and combinations with other pharmaceutical active ingredients.

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