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(E)-3-(4-BROMO-2-FLUOROPHENYL)ACRYLOYL CHLORIDE is a chemical compound with the molecular formula C9H5BrClF. It is an acryloyl chloride derivative, which means it contains a reactive acyl chloride group attached to an acryloyl group. The (E)-configuration indicates that the bromine and fluorine substituents are on opposite sides of the double bond in the acryloyl group. It is a highly reactive compound and should be handled with care, as it can react vigorously with water and alcohols, releasing toxic hydrogen chloride gas.

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  • 676348-49-5 Structure
  • Basic information

    1. Product Name: (E)-3-(4-BROMO-2-FLUOROPHENYL)ACRYLOYL CHLORIDE
    2. Synonyms: 3-(4-BROMO-2-FLUORO-PHENYL)-ACRYLOYL CHLORIDE;(E)-3-(4-BROMO-2-FLUOROPHENYL)ACRYLOYL CHLORIDE
    3. CAS NO:676348-49-5
    4. Molecular Formula: C9H5BrClFO
    5. Molecular Weight: 263.49
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 676348-49-5.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: (E)-3-(4-BROMO-2-FLUOROPHENYL)ACRYLOYL CHLORIDE(CAS DataBase Reference)
    10. NIST Chemistry Reference: (E)-3-(4-BROMO-2-FLUOROPHENYL)ACRYLOYL CHLORIDE(676348-49-5)
    11. EPA Substance Registry System: (E)-3-(4-BROMO-2-FLUOROPHENYL)ACRYLOYL CHLORIDE(676348-49-5)
  • 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: 676348-49-5(Hazardous Substances Data)

676348-49-5 Usage

Uses

Used in Pharmaceutical Industry:
(E)-3-(4-BROMO-2-FLUOROPHENYL)ACRYLOYL CHLORIDE is used as a building block in organic synthesis for the preparation of pharmaceuticals. Its unique structure and reactivity make it a valuable intermediate in the development of new drugs with potential therapeutic applications.
Used in Agrochemical Industry:
(E)-3-(4-BROMO-2-FLUOROPHENYL)ACRYLOYL CHLORIDE is also used as a building block in organic synthesis for the preparation of agrochemicals. Its properties allow for the creation of new compounds that can be used in the development of pesticides, herbicides, and other agricultural products to improve crop yields and protect against pests.

Check Digit Verification of cas no

The CAS Registry Mumber 676348-49-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 6,7,6,3,4 and 8 respectively; the second part has 2 digits, 4 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 676348-49:
(8*6)+(7*7)+(6*6)+(5*3)+(4*4)+(3*8)+(2*4)+(1*9)=205
205 % 10 = 5
So 676348-49-5 is a valid CAS Registry Number.

676348-49-5SDS

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 (E)-3-(4-Bromo-2-fluorophenyl)acryloylchloride

1.2 Other means of identification

Product number -
Other names -

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:676348-49-5 SDS

676348-49-5Relevant articles and documents

Design, Synthesis, Structure-Activity Relationship, Molecular Docking, and Herbicidal Evaluation of 2-Cinnamoyl-3-Hydroxycyclohex-2-en-1-one Derivatives as Novel 4-Hydroxyphenylpyruvate Dioxygenase Inhibitors

Song, Hao-Min,Zhao, Li-Xia,Zhang, Shuai-Qi,Ye, Tong,Fu, Ying,Ye, Fei

, p. 12621 - 12633 (2021/11/13)

Cinnamic acid, isolated from cinnamon bark, is a natural product with excellent bioactivity, and it effectively binds with cyclohexanedione to form novel 4-hydroxyphenylpyruvate dioxygenase (HPPD) inhibitors. According to the active sub-structure combinat

Organocatalytic access to enantioenriched dihydropyran phosphonates via an inverse-electron-demand hetero-Diels-Alder reaction

Weise, Christian F.,Lauridsen, Vibeke H.,Rambo, Raoní S.,Iversen, Eva H.,Olsen, Marie-Luise,J?rgensen, Karl Anker

, p. 3537 - 3546 (2014/05/06)

The enantioselective inverse-electron-demand hetero-Diels-Alder reaction of the remote olefin functionality in dienamines has been developed by the simultaneous activation of α,β-unsaturated aldehydes and acyl phosphonates. The dual activation is based on an organocatalyst that activates both the α,β-unsaturated aldehyde, through dienamine formation, and the acyl phosphonate by hydrogen-bonding. The enantioselective reaction results in the formation of dihydropyran frameworks with three contiguous stereogenic centers. Different substitution patterns are possible for both the heterodiene and the dienophile, and the target products are obtained in good yields and up to 92% ee. The potential of the reaction is demonstrated by transformation of the products into valuable and complex synthons.

PHARMACEUTICALLY ACTIVE BENZOXAZOLE, BENZTHIAZOLE AND BENZIMIDAZOLE ACID DERIVATIVES

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Page 47, (2010/02/07)

Compounds of formula (I): wherein R1, R2 and R3 are independently, hydrogen, halogen, CF3, OR6, NR7R8, NR8COR10, NR8SO2R10 or C1-6 alkyl optionally substituted by hydroxy, C1-6 alkoxy or NR7R8; R4 is NR8CONR8R9, NR8COR9, NR8SO2R9, or W-CONR8R9, where W is a bond, C1-6 alkylene, C2-6 alkenylene or C2-6 alkynylene; and R5 is Formula (A) methods for their synthesis, pharmaceutical compositions comprising them and their use in medicine, in particular for the treatment of cancer.

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