63365-23-1

Basic information

• Product Name: 2-AMINO-6-NITROBENZONITRILE
• Synonyms: 2-AMINO-6-NITROBENZONITRILE
• CAS NO: 63365-23-1
• Molecular Formula: C₇H₅N₃O₂
• Molecular Weight: 163.13
• Mol File: 63365-23-1.mol
• Article Data: 6

Chemical Properties

• Melting Point: 192-196 °C(Solv: ethyl acetate (141-78-6); hexane (110-54-3))
• Boiling Point: 410°C at 760 mmHg
• Flash Point: 201.7°C
• Appearance: /
• Density: 1.41g/cm³
• Vapor Pressure: 6.25E-07mmHg at 25°C
• Refractive Index: 1.626
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• PKA: -0.33±0.10(Predicted)
• CAS DataBase Reference: 2-AMINO-6-NITROBENZONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-AMINO-6-NITROBENZONITRILE(63365-23-1)
• EPA Substance Registry System: 2-AMINO-6-NITROBENZONITRILE(63365-23-1)

Safety Data

• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39
• RIDADR: 3439
• Hazardous Substances Data: 63365-23-1(Hazardous Substances Data)

Usage

Synthesis Reference(s)

Journal of Medicinal Chemistry, 24, p. 742, 1981 DOI: 10.1021/jm00138a020

InChI:InChI=1/C7H5N3O2/c8-4-5-6(9)2-1-3-7(5)10(11)12/h1-3H,9H2

Upstream product

• 35213-00-4 2,6-dinitrobenzonitrile 
• 606-21-3 1-chloro-2,6-dinitrobenzene 

Downstream Products

• 79603-02-4 2-bromo-6-nitrobenzonitrile 
• 79603-05-7 2-iodo-6-nitrobenzonitrile 
• 63404-53-5 (3-nitro-2-cyanophenylamino) oxoacetic acid ethyl ester 
• 77326-60-4 N-(2-cyano-3-nitrophenyl)acetamide 
• 77326-44-4 N-(3-Amino-2-cyano-phenyl)-acetamide 
• 77326-35-3 N-(3-Acetylamino-2-cyano-phenyl)-oxalamic acid ethyl ester 
• 77326-62-6 2-amino-6-bromobenzonitrile 
• 123241-50-9 2-amino-6-iodobenzonitrile 
• 119584-75-7 5-bromo-2,4-diaminoquinazoline 
• 123241-51-0 2-amino-6-(phenylethynyl)benzonitrile 
• 123241-52-1 2-amino-6-(phenylethyl)benzonitrile 
• 119584-76-8 2,4-diamino-5-iodoquinazoline 
• 123242-02-4 5-Phenethyl-quinazoline-2,4-diamine 

Relevant articles and documents

NEW BRAF INHIBITORS AS PARADOX BREAKERS

The invention provides a novel compound having the general formula (I) (I) wherein R1-R3 and X are as defined in the description and in the claims. The compound of formula (I) can be used as a medicament.

Antifolate and Antibacterial Activities of 5-Substituted 2,4-Diaminoquinazolines

A series of 5-substituted 2,4-diaminoquinazolines (3) has been synthesized and evaluated as inhibitors of the enzyme dihydrofolate reductase (DHFR) from both bacterial and mammalian sources.The best compounds (e.g. 53) show good activity against Escherichia coli DHFR, but there is no significant selectivity for the bacterial over the mammalian enzyme.The structure-activity relationships for enzyme inhibition appear to be complex and not amenable to simple analysis; a hypotesis to explain the observed qualitative structure-activity relationships is proposed.The inhibitory activities of the compounds against the growth of intact bacterial cells in vitro closely parallel those for the inhibition of the isolated bacterial enzymes, suggesting that their antifolate action is responsible for their antibacterial effects.Five of the compounds were tested for their ability to cure a systemic E. coli infection in the mouse, but they showed no therapeutic effects at their maximum tolerated doses.

Antisecretory oxamic acid esters

Variously substituted oxanilic acid esters possessing anti-secretory activity are useful anti-ulcer agents.