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2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE, also known as ACMB, is a chemical compound characterized by its molecular formula C8H6ClN. It is a white to off-white solid that exhibits solubility in organic solvents. ACMB's unique chemical structure endows it with a broad spectrum of applications, making it a valuable building block in the synthesis of pharmaceuticals, agrochemicals, dyes, pigments, and various heterocyclic compounds.

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  • 289686-80-2 Structure
  • Basic information

    1. Product Name: 2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE
    2. Synonyms: 2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE
    3. CAS NO:289686-80-2
    4. Molecular Formula: C8H7ClN2
    5. Molecular Weight: 166.61
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 289686-80-2.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: 2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE(CAS DataBase Reference)
    10. NIST Chemistry Reference: 2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE(289686-80-2)
    11. EPA Substance Registry System: 2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE(289686-80-2)
  • 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: 289686-80-2(Hazardous Substances Data)

289686-80-2 Usage

Uses

Used in Pharmaceutical Industry:
2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE is used as a building block for the synthesis of pharmaceuticals due to its unique chemical structure, which allows for the creation of a wide range of medicinal compounds.
Used in Agrochemical Industry:
In the agrochemical industry, 2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE is utilized as a building block for the synthesis of agrochemicals, contributing to the development of effective crop protection agents.
Used in Dye and Pigment Production:
2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE is used as a key intermediate in the production of dyes and pigments, thanks to its chemical properties that facilitate the creation of diverse colorants.
Used in Heterocyclic Compound Synthesis:
As an intermediate, 2-AMINO-4-CHLORO-5-METHYL-BENZONITRILE is employed in the synthesis of various heterocyclic compounds, which are important in numerous chemical and pharmaceutical applications.

Check Digit Verification of cas no

The CAS Registry Mumber 289686-80-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,8,9,6,8 and 6 respectively; the second part has 2 digits, 8 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 289686-80:
(8*2)+(7*8)+(6*9)+(5*6)+(4*8)+(3*6)+(2*8)+(1*0)=222
222 % 10 = 2
So 289686-80-2 is a valid CAS Registry Number.

289686-80-2 Well-known Company Product Price

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  • Aldrich

  • (JWP00056)  2-Amino-4-chloro-5-methyl-benzonitrile  AldrichCPR

  • 289686-80-2

  • JWP00056-1G

  • 6,124.95CNY

  • Detail

289686-80-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-amino-4-chloro-5-methylbenzonitrile

1.2 Other means of identification

Product number -
Other names 2-AMINO-4-CHLORO-5-METHYLBENZONITRILE

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:289686-80-2 SDS

289686-80-2Downstream Products

289686-80-2Relevant articles and documents

Anti-quinazoline compounds

-

Page column 15, (2010/02/05)

Dihydroquinazoline derivatives of the formula where R3is —(CH2)p—A where p is from 1 to 4 and A is a 5- or 6-membered N-containing heterocyclic ring attached via the N atom or A is —NA′A″ wherein A′ and A″ are the same or different and are each a C1-C4alkyl group or their pharmaceutically acceptable salts possessing anti-cancer activity.

The design and synthesis of water-soluble analogues of CB30865, a quinazolin-4-one-based antitumor agent

Bavetsias,Skelton,Yafai,Mitchell,Wilson,Allan,Jackman

, p. 3692 - 3702 (2007/10/03)

4-[N-[7-Bromo-2-methyl-4-oxo-3,4-dihydroquinazolin-6-ylmethyl] -N-(prop-2-ynyl)amino]-N-(3-pyridylmethyl)benzamide (CB30865) is a quinazolin-4-one antitumor agent whose high growthinhibitory activity (W1L2 IC50 = 2.8 ± 0.50 nM) is believed to have a folate-independent locus of action. In addition, CB30865 represents a class of compounds with unique biochemical characteristics such as a delayed, non-phase specific, cell-cycle arrest. The low aqueous solubility of CB30865 prompted a search for more water-soluble analogues for in vivo evaluation of this class of compounds. It was thought that aqueous solubility could be increased by the introduction of amino functionalities at the 2-position of the quinazolin-4-one ring. A variety of compounds (5a-j, 31a-c, 32, and 33) were synthesized in a linear fashion starting from 3-chloro-4-methylaniline. Most of these compounds (e.g., 5a, 5b, 5g) were significantly more water-soluble than CB30865 (636 μM for 5a at pH 6 and 992 μM for 5g at pH 6). In addition, some of them were up to 6-fold more cytotoxic than CB30865 (e.g., for 5a, W1L2 IC50 = 0.49 ± 0.24 nM) and retained its novel biochemical characteristics.

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