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5-Benzothiazolecarbonitrile,2-amino-(9CI) is a chemical compound with the molecular formula C8H5N3S. It is a benzothiazole derivative that features an amino group and a cyano group. 5-Benzothiazolecarbonitrile,2-amino-(9CI) is utilized in organic synthesis and pharmaceutical research as a key building block for the creation of a variety of pharmaceuticals, agrochemicals, and other fine chemicals. Its unique structural attributes make it a valuable intermediate in the production of a wide range of chemical compounds, garnering interest from researchers and industry professionals in the fields of chemistry and pharmaceuticals.

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  • 105314-08-7 Structure
  • Basic information

    1. Product Name: 5-Benzothiazolecarbonitrile,2-amino-(9CI)
    2. Synonyms: 5-Benzothiazolecarbonitrile,2-amino-(9CI);2-Amino-5-cyanobenzothiazole;2-AMino-5-benzothiazolecarbonitrile;5-Benzothiazolecarbonitrile, 2-aMino-
    3. CAS NO:105314-08-7
    4. Molecular Formula: C8H5N3S
    5. Molecular Weight: 175.214
    6. EINECS: N/A
    7. Product Categories: BENZOTHIAZOLE
    8. Mol File: 105314-08-7.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 399.7 °C at 760 mmHg
    3. Flash Point: 195.5 °C
    4. Appearance: /
    5. Density: 1.45
    6. Refractive Index: N/A
    7. Storage Temp.: 2-8°C(protect from light)
    8. Solubility: N/A
    9. CAS DataBase Reference: 5-Benzothiazolecarbonitrile,2-amino-(9CI)(CAS DataBase Reference)
    10. NIST Chemistry Reference: 5-Benzothiazolecarbonitrile,2-amino-(9CI)(105314-08-7)
    11. EPA Substance Registry System: 5-Benzothiazolecarbonitrile,2-amino-(9CI)(105314-08-7)
  • 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: 105314-08-7(Hazardous Substances Data)

105314-08-7 Usage

Uses

Used in Pharmaceutical Research and Development:
5-Benzothiazolecarbonitrile,2-amino-(9CI) is used as a building block in the synthesis of pharmaceuticals for the treatment of various diseases and medical conditions. Its incorporation into drug molecules can potentially enhance their therapeutic properties and efficacy.
Used in Organic Synthesis:
In the realm of organic synthesis, 5-Benzothiazolecarbonitrile,2-amino-(9CI) is used as a versatile intermediate for the production of diverse chemical compounds. Its presence in the molecular structure can influence the reactivity and selectivity of the compounds, making it a valuable component in the synthesis process.
Used in Agrochemical Development:
5-Benzothiazolecarbonitrile,2-amino-(9CI) is also utilized in the development of agrochemicals, where it can contribute to the creation of new pesticides, herbicides, or other agricultural chemicals. Its structural features may offer novel modes of action or improved performance in these applications.
Used in Fine Chemicals Production:
5-Benzothiazolecarbonitrile,2-amino-(9CI) is employed in the production of fine chemicals, which are high-purity chemicals used in various industries such as pharmaceuticals, fragrances, and flavors. The unique properties of 5-Benzothiazolecarbonitrile,2-amino-(9CI) make it suitable for the synthesis of specialty chemicals with specific applications.

Check Digit Verification of cas no

The CAS Registry Mumber 105314-08-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,5,3,1 and 4 respectively; the second part has 2 digits, 0 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 105314-08:
(8*1)+(7*0)+(6*5)+(5*3)+(4*1)+(3*4)+(2*0)+(1*8)=77
77 % 10 = 7
So 105314-08-7 is a valid CAS Registry Number.

105314-08-7SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-amino-1,3-benzothiazole-5-carbonitrile

1.2 Other means of identification

Product number -
Other names 2-AMINO-5-CYANOBENZOTHIAZOLE

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:105314-08-7 SDS

105314-08-7Upstream product

105314-08-7Downstream Products

105314-08-7Relevant articles and documents

Electrochemical intramolecular c-h amination: Synthesis of benzoxazoles and benzothiazoles

Morofuji, Tatsuya,Shimizu, Akihiro,Yoshida, Jun-Ichi

supporting information, p. 3211 - 3214 (2015/03/05)

A new method for metal-free intramolecular C-H amination has been developed. Electrochemical oxidation of 2-pyrimidyloxybenzenes and 2-pyrimidylthiobenzenes, which can be easily prepared from phenols and thiophenols, respectively, followed by the treatment of the resulting pyrimidinium ions with piperidine gives 2-aminobenzoxazoles and 2-aminobenzothiazoles, respectively.

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