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
• Article Data: 11

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

Description

3-Isopropoxyaniline, also known as m-Isopropoxyaniline, is an organic compound with the chemical formula C9H13NO. It is a colorless oil liquid and serves as a crucial reactant in the synthesis of various chemical compounds.

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

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

Downstream Products

• 74699-48-2 2-amino-N-(3-isopropoxyphenyl)benzamide 
• 653604-42-3 6-[N-(3-isopropoxyphenyl)carbamyl]-2-naphthalenecarbonitrile 
• 55814-41-0 mepronil 
• 942999-26-0 3,5-dichloro-2,4-difluoro-N-(3-isopropoxyphenyl)-benzamide 
• 58494-85-2 3'-isopropoxy-2-bromobenzanilide 
• 66332-96-5 flutolanil 
• 103-81-1 Benzeneacetamide 
• 438249-14-0 4-(3-Isopropoxyanilino)-6-methyl-2-(2-pyridinyl)pyrimidine 
• 767337-13-3 N-(3-isopropoxy-phenyl)-3-trifluoromethyl-thiophene-4-carboxamide 
• 860585-54-2 3-isopropoxy-N,N-dimethyl-4-nitroso-aniline 
• 133040-77-4 LY 202769 
• 133040-68-3 LY 247348 
• 180423-10-3 benzoic acid, 3-[[[2-[3,4-dihydro-3-[3-(1-methylethoxy)phenyl]-4-oxo-2-quinazolinyl]-hydrazino]carbonyl]amino]-, 1,1-dimethylethyl ester 

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