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  • 840481-82-5 Structure
  • Basic information

    1. Product Name: Benzonitrile, 3-bromo-2-fluoro- (9CI)
    2. Synonyms: Benzonitrile, 3-bromo-2-fluoro- (9CI);3-BROMO-2-FLUOROBENZONITRILE 96%;KaiXinTianRui Technology Development Co., Ltd;3-Bromo-2-fluorobenzonitrile;1-Bromo-3-cyano-2-fluorobenzene;Benzonitrile, 3-broMo-2-fluoro-
    3. CAS NO:840481-82-5
    4. Molecular Formula: C7H3BrFN
    5. Molecular Weight: 200.0078232
    6. EINECS: N/A
    7. Product Categories: FLUORO;Bromine Compounds;Fluorine Compounds;Nitriles;Fluorine series
    8. Mol File: 840481-82-5.mol
    9. Article Data: 2
  • Chemical Properties

    1. Melting Point: 37-40°C
    2. Boiling Point: 221.869 °C at 760 mmHg
    3. Flash Point: 87.983 °C
    4. Appearance: /
    5. Density: 1.695 g/cm3
    6. Vapor Pressure: 0.105mmHg at 25°C
    7. Refractive Index: 1.578
    8. Storage Temp.: Sealed in dry,Room Temperature
    9. Solubility: N/A
    10. CAS DataBase Reference: Benzonitrile, 3-bromo-2-fluoro- (9CI)(CAS DataBase Reference)
    11. NIST Chemistry Reference: Benzonitrile, 3-bromo-2-fluoro- (9CI)(840481-82-5)
    12. EPA Substance Registry System: Benzonitrile, 3-bromo-2-fluoro- (9CI)(840481-82-5)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: N/A
    3. Safety Statements: N/A
    4. RIDADR: 3439
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: IRRITANT
    8. PackingGroup:
    9. Hazardous Substances Data: 840481-82-5(Hazardous Substances Data)

840481-82-5 Usage

Description

Benzonitrile, 3-bromo-2-fluoro(9CI), is a chemical compound characterized by the molecular formula C7H3BrFN. It is a derivative of benzonitrile, distinguished by the presence of a bromine atom at the 3rd position and a fluorine atom at the 2nd position on the benzene ring. This unique substitution pattern endows the compound with distinct chemical and physical properties, which are advantageous in various applications within the pharmaceutical and chemical industries. Benzonitrile, 3-bromo-2-fluoro(9CI) serves as a versatile building block for the synthesis of other complex organic molecules.

Uses

Used in Pharmaceutical Industry:
Benzonitrile, 3-bromo-2-fluoro(9CI), is utilized as an intermediate in the synthesis of pharmaceutical compounds. Its specific substitution pattern allows for the development of new drugs with unique therapeutic properties. Benzonitrile, 3-bromo-2-fluoro(9CI)'s reactivity and structural features make it a valuable component in the creation of novel medicinal agents.
Used in Chemical Industry:
In the chemical industry, Benzonitrile, 3-bromo-2-fluoro(9CI), is employed as a building block for the synthesis of various organic compounds. Its unique substitution pattern on the benzene ring provides a foundation for the development of new chemical entities with specific applications in areas such as materials science, agrochemicals, and specialty chemicals.
Used in Research and Development:
Benzonitrile, 3-bromo-2-fluoro(9CI), is also used in research and development settings to explore its potential applications and properties. Scientists and researchers leverage the compound's unique characteristics to investigate its reactivity, stability, and interactions with other molecules, paving the way for new discoveries and innovations in the field of chemistry.

Check Digit Verification of cas no

The CAS Registry Mumber 840481-82-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,4,0,4,8 and 1 respectively; the second part has 2 digits, 8 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 840481-82:
(8*8)+(7*4)+(6*0)+(5*4)+(4*8)+(3*1)+(2*8)+(1*2)=165
165 % 10 = 5
So 840481-82-5 is a valid CAS Registry Number.
InChI:InChI=1/C7H3BrFN/c8-6-3-1-2-5(4-10)7(6)9/h1-3H

840481-82-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-Bromo-2-Fluorobenzonitrile

1.2 Other means of identification

Product number -
Other names 3-bromo-2-fluorobenzonitrile

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:840481-82-5 SDS

840481-82-5Relevant articles and documents

STK4 INHIBITORS FOR TREATMENT OF HEMATOLOGIC MALIGNANCIES

-

Paragraph 00753, (2017/01/09)

The application relates to compounds of Formula (I'): which modulate the activity of a kinase (e.g., STK4), a pharmaceutical composition comprising the compound, and a method of treating or preventing a disease or disorder associated with the modulation of a kinase, such as STK4.

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