41406-00-2

Basic information

• Product Name: 3-ISOPROPOXYANILINE
• Synonyms: TIMTEC-BB SBB010221;M-ISOPROPYL ANILINE;3-ISOPROPOXY-PHENYLAMINE;3-ISOPROPOXYLANILINE;3-ISOPROPOXYANILINE;AKOS BC-2543;Isopropoxyaniline;m-Isopropoxyaniline
• CAS NO: 41406-00-2
• Molecular Formula: C₉H₁₃NO
• Molecular Weight: 151.21
• Product Categories: Amines;C9 to C10;Nitrogen Compounds
• Mol File: 41406-00-2.mol

Chemical Properties

• Boiling Point: 229-230 °C(lit.)
• Flash Point: >230 °F
• Appearance: /
• Density: 1.025 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.0131mmHg at 25°C
• Refractive Index: n20/D 1.5500(lit.)
• Storage Temp.: Refrigerator
• Solubility: Chloroform (Slightly), Methanol (Slightly)
• PKA: 4.54±0.10(Predicted)
• CAS DataBase Reference: 3-ISOPROPOXYANILINE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-ISOPROPOXYANILINE(41406-00-2)
• EPA Substance Registry System: 3-ISOPROPOXYANILINE(41406-00-2)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 41406-00-2(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
3-Isopropoxyaniline is used as a reactant for the preparation of [1,2,3]triazolo[4,5-d]pyrimidinones, which are inhibitors of Chikungunya virus replication. This application is significant in the development of antiviral drugs to combat the Chikungunya virus, a mosquito-borne disease that causes severe joint pain, fever, and other symptoms.

InChI:InChI=1/C9H13NO/c1-7(2)11-9-5-3-4-8(10)6-9/h3-7H,10H2,1-2H3

Upstream product

• 88991-53-1 3-(1-Methylethoxy)nitrobenzene 
• 117855-66-0 (3-Isopropoxy-phenyl)-carbamic acid 2-piperidin-1-yl-ethyl ester; hydrochloride 
• 591-27-5 m-Hydroxyaniline 
• 75-26-3 isopropyl bromide 
• 75-29-6 isopropyl chloride 
• 111-96-6 diethylene glycol dimethyl ether 
• 127-19-5 N,N-dimethyl acetamide 
• 4965-17-7 tetrapentylammonium chloride 
• 67-63-0 isopropyl alcohol 
• 39657-48-2 4-acetoxy-3,5-dimethoxycinnamic acid chloride 
• 62-53-3 aniline 
• 554-84-7 meta-nitrophenol 

Downstream Products

• 256425-12-4 N-(3-isopropoxyphenyl)acetamide 
• 860735-61-1 3-isopropoxy-N,N-dimethyl-aniline 
• 74699-48-2 2-amino-N-(3-isopropoxyphenyl)benzamide 
• 125802-59-7 (9-Benzyl-2-chloro-9H-purin-6-yl)-(3-isopropoxy-phenyl)-amine 
• 205063-49-6 [3-(3-Isopropoxy-phenyl)-4-oxo-3,4-dihydro-quinazolin-2-ylmethyl]-carbamic acid benzyl ester 
• 205063-51-0 {2-[3-(3-Isopropoxy-phenyl)-4-oxo-3,4-dihydro-quinazolin-2-yl]-ethyl}-carbamic acid benzyl ester 
• 3528-90-3 3-isopropoxy-phenyl isothiocyanate 
• 191993-62-1 N-(3-isopropoxyphenyl)-4-chloropyridine-3-sulphonamide 
• 222036-91-1 N-(tert-butyloxy-carbonyl)-3-isopropoxyaniline 
• 653604-42-3 6-[N-(3-isopropoxyphenyl)carbamyl]-2-naphthalenecarbonitrile 
• 748772-17-0 N'-(3-isopropoxy-phenyl)-ethane-1,2-diamine 
• 918408-65-8 2-bromo-N-(3-isopropoxyphenyl)acetamide 
• 863028-85-7 2-chloro-4-(3-isopropoxyanilino)pyrimidine-5-carboxylic acid 
• 863028-90-4 2-(1H-benzotriazol-1-yloxy)-4-(3-isopropoxyanilino)pyrimidine-5-carboxamide 

Relevant articles and documents

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