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1-(Benzyloxy)-4-bromo-2,3-difluorobenzene is a chemical compound with the molecular formula C13H9BrF2O. It is a benzene derivative featuring a bromine and two fluorine atoms attached to the benzene ring, along with a benzyloxy group, which consists of an oxygen atom connected to a benzene ring through a benzyl group. This unique structure and reactivity make it a valuable compound in the realms of organic synthesis and pharmaceuticals.

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  • 941294-52-6 Structure
  • Basic information

    1. Product Name: 1-(Benzyloxy)-4-bromo-2,3-difluorobenzene
    2. Synonyms: 1-Bromo-4-(benzyloxy)-2,3-difluorobenzene;Benzyl 4-bromo-2,3-difluorophenyl ether, 4-(Benzyloxy)-2,3-difluorobromobenzene;1-(Benzyloxy)-4-bromo-2,3-difluorobenzene98%
    3. CAS NO:941294-52-6
    4. Molecular Formula: C13H9BrF2O
    5. Molecular Weight: 299.12
    6. EINECS: N/A
    7. Product Categories: blocks;Bromides
    8. Mol File: 941294-52-6.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 335.4°C at 760 mmHg
    3. Flash Point: 188.6°C
    4. Appearance: /
    5. Density: 1.505g/cm3
    6. Vapor Pressure: 0.000234mmHg at 25°C
    7. Refractive Index: 1.568
    8. Storage Temp.: 2-8°C
    9. Solubility: N/A
    10. CAS DataBase Reference: 1-(Benzyloxy)-4-bromo-2,3-difluorobenzene(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1-(Benzyloxy)-4-bromo-2,3-difluorobenzene(941294-52-6)
    12. EPA Substance Registry System: 1-(Benzyloxy)-4-bromo-2,3-difluorobenzene(941294-52-6)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 941294-52-6(Hazardous Substances Data)

941294-52-6 Usage

Uses

Used in Organic Synthesis:
1-(Benzyloxy)-4-bromo-2,3-difluorobenzene is used as a building block for the synthesis of more complex organic molecules. Its distinct functional groups allow for various chemical reactions, facilitating the creation of a wide range of organic compounds with diverse properties and applications.
Used in Pharmaceutical Development:
In the pharmaceutical industry, 1-(Benzyloxy)-4-bromo-2,3-difluorobenzene is utilized as a starting material for the development of new pharmaceutical drugs. Its unique structure can be modified to produce drug candidates with potential therapeutic effects, contributing to the advancement of medicine and treatment options for various diseases and conditions.

Check Digit Verification of cas no

The CAS Registry Mumber 941294-52-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 9,4,1,2,9 and 4 respectively; the second part has 2 digits, 5 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 941294-52:
(8*9)+(7*4)+(6*1)+(5*2)+(4*9)+(3*4)+(2*5)+(1*2)=176
176 % 10 = 6
So 941294-52-6 is a valid CAS Registry Number.
InChI:InChI=1/C13H9BrF2O/c14-10-6-7-11(13(16)12(10)15)17-8-9-4-2-1-3-5-9/h1-7H,8H2

941294-52-6SDS

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 1-bromo-2,3-difluoro-4-phenylmethoxybenzene

1.2 Other means of identification

Product number -
Other names PC7574

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:941294-52-6 SDS

941294-52-6Relevant articles and documents

PHENOXY-PYRIDYL-PYRIMIDINE COMPOUNDS AND METHODS OF USE

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Paragraph 0489, (2020/05/06)

Described herein are phenoxy-pyridyl -pyrimidine compounds with inositol requiring enzyme 1 (IRE1) modulation activity or function having the Formula I structure or stereoisomers, tautomers, or pharmaceutically acceptable salts thereof, and with the substituents and structural features described herein. Also described are pharmaceutical compositions and medicaments that include the Formula I compounds, as well as methods of using such IRE1 modulators, alone and in combination with other therapeutic agents, for treating diseases or conditions that are mediated or dependent upon estrogen receptors.

P-Hydroxyphenacyl photoremovable protecting groups Robust photochemistry despite substituent diversity

Givens, Richard S.,Stensrud, Kenneth,Conrad, Peter G.,Yousef, Abraham L.,Perera, Chamani,Senadheera, Sanjeewa N.,Heger, Dominik,Wirz, Jakob

, p. 364 - 384 (2011/06/22)

A broadly based investigation of the effects of a diverse array of substituents on the photochemical rearrangement of p-hydroxyphenacyl esters has demonstrated that common substituents such as F, MeO, CN, CO2R, CONH2, and CH3 have little effect on the rate and quantum efficiencies for the photo-Favorskii rearrangement and the release of the acid leaving group or on the lifetimes of the reactive triplet state. A decrease in the quantum yields across all substituents was observed for the release and rearrangement when the photolyses were carried out in buffered aqueous media at pHs that exceeded the ground-state pKa of the chromophore where the conjugate base is the predominant form. Otherwise, substituents have only a very modest effect on the photoreaction of these robust chromophores.

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