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2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine is a thioether chemical compound with the molecular formula C10H12ClFN2S. It features an amine functional group attached to a benzyl moiety, which is substituted with a chlorine and a fluorine atom. This unique structure endows it with potential biological activity and makes it a valuable building block for organic synthesis in various fields.

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  • 175136-76-2 Structure
  • Basic information

    1. Product Name: 2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine
    2. Synonyms: 2-(2-CHLORO-6-FLUOROBENZYLTHIO)ETHYLAMINE;BUTTPARK 29\08-96;2-(2-Chloro-6-fluorobenzylthio)ethylamine 97%;2-(2-Chloro-6-fluorobenzylthio)ethylamine97%;Aminoethyl (2-chloro-6-fluorobenzyl) sulphide;2-[(2-Chloro-6-fluorobenzyl)thio]ethanamine;2-Aminoethyl 2-chloro-6-fluorobenzyl sulphide 97%;2-Aminoethyl2-chloro-6-fluorobenzylsulphide97%
    3. CAS NO:175136-76-2
    4. Molecular Formula: C9H11ClFNS
    5. Molecular Weight: 219.71
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 175136-76-2.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 140 °C
    3. Flash Point: 134.2 °C
    4. Appearance: /
    5. Density: 1.273 g/cm3
    6. Vapor Pressure: 0.00128mmHg at 25°C
    7. Refractive Index: 1.572
    8. Storage Temp.: 2-8°C
    9. Solubility: N/A
    10. PKA: 8.85±0.10(Predicted)
    11. CAS DataBase Reference: 2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine(CAS DataBase Reference)
    12. NIST Chemistry Reference: 2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine(175136-76-2)
    13. EPA Substance Registry System: 2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine(175136-76-2)
  • Safety Data

    1. Hazard Codes: C
    2. Statements: 34
    3. Safety Statements: 26-36/37/39-45
    4. RIDADR: 2735
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: CORROSIVE
    8. PackingGroup: N/A
    9. Hazardous Substances Data: 175136-76-2(Hazardous Substances Data)

175136-76-2 Usage

Uses

Used in Pharmaceutical Industry:
2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine is used as a pharmaceutical intermediate for the development of new drugs. Its chemical structure allows for the creation of diverse molecules with potential therapeutic applications, making it a promising candidate for medicinal chemistry.
Used in Organic Synthesis:
In the field of organic synthesis, 2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine serves as a versatile building block. Its reactivity and functional groups enable it to participate in various chemical reactions, leading to the formation of a wide range of molecules with different properties and applications.
Used in Medicinal Chemistry:
2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine is utilized in medicinal chemistry for the design and synthesis of bioactive compounds. Its unique structure, including the benzyl group and halogen atoms, can contribute to the modulation of biological targets, potentially leading to the discovery of new drugs with improved efficacy and selectivity.
Used in Agriculture:
In the agricultural sector, 2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine may find applications as a precursor for the synthesis of agrochemicals, such as pesticides and herbicides. Its chemical properties can be harnessed to create molecules with specific modes of action against pests and weeds, contributing to more effective and sustainable agricultural practices.
Used in Materials Science:
2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine can also be employed in materials science for the development of novel materials with unique properties. Its ability to participate in various chemical reactions allows for the creation of materials with potential applications in areas such as polymer science, coatings, and adhesives.

Check Digit Verification of cas no

The CAS Registry Mumber 175136-76-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,7,5,1,3 and 6 respectively; the second part has 2 digits, 7 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 175136-76:
(8*1)+(7*7)+(6*5)+(5*1)+(4*3)+(3*6)+(2*7)+(1*6)=142
142 % 10 = 2
So 175136-76-2 is a valid CAS Registry Number.
InChI:InChI=1/C9H11ClFNS/c10-8-2-1-3-9(11)7(8)6-13-5-4-12/h1-3H,4-6,12H2

175136-76-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(2-Chloro-6-fluorobenzylthio)ethylamine

1.2 Other means of identification

Product number -
Other names 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethanamine

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:175136-76-2 SDS

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