39496-82-7

Basic information

• Product Name: 4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID
• Synonyms: 4-OXO-4-(4-N-PROPOXYPHENYL)BUTYRIC ACID;4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID;3-(4-N-PROPYLOXYBENZOYL)PROPIONIC ACID
• CAS NO: 39496-82-7
• Molecular Formula: C13H16O4
• Molecular Weight: 236.26
• Mol File: 39496-82-7.mol
• Article Data: 1

Chemical Properties

• Melting Point: 114-115 °C
• Boiling Point: 435°Cat760mmHg
• Flash Point: 166.4°C
• Appearance: /
• Density: 1.149g/cm³
• Vapor Pressure: 2.44E-08mmHg at 25°C
• Refractive Index: 1.525
• PKA: 4.59±0.17(Predicted)
• CAS DataBase Reference: 4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID(39496-82-7)
• EPA Substance Registry System: 4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID(39496-82-7)

Safety Data

• Hazard Codes: Xi:Irritant
• Statements: R36/37/38:Irritating to eyes, respiratory system and skin.
• Safety Statements: S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39:Wear suitable g
• Hazardous Substances Data: 39496-82-7(Hazardous Substances Data)

Usage

Description

4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID, a compound with the chemical formula C15H20O3, is a white to off-white powder that is soluble in organic solvents. It is known for its anti-inflammatory and analgesic properties, making it a promising candidate for pharmaceutical applications. Furthermore, it may also serve as an intermediate in the synthesis of other organic compounds, although further research is required to fully explore its potential applications and effects.

Uses

Used in Pharmaceutical Industry:
4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID is used as an active pharmaceutical ingredient for its anti-inflammatory and analgesic properties, providing relief from pain and reducing inflammation in various conditions.
Used in Research Applications:
In the research field, 4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID is utilized as a chemical probe to study its potential effects on biological systems and to explore its mechanism of action.
Used as an Intermediate in Organic Synthesis:
4-OXO-4-(4-PROPOXYPHENYL)BUTANOIC ACID is employed as a key intermediate in the synthesis of other organic compounds, contributing to the development of new chemical entities with potential applications in various industries.

InChI:InChI=1/C13H16O4/c1-2-9-17-11-5-3-10(4-6-11)12(14)7-8-13(15)16/h3-6H,2,7-9H2,1H3,(H,15,16)

Upstream product

• 66123-43-1 4-(4-hydroxyphenyl)-4-oxobutanoic acid ethyl ester 
• 106-94-5 propyl bromide 
• 108-30-5 succinic acid anhydride 
• 622-85-5 propoxybenzene 

Relevant articles and documents

Pyridazinones

Compounds of the general formula: SPC1 In which X represents a straight or branched chain alkyl or alkoxy group, a hydroxymethyl group, a cycloalkyl group, a cycloalkoxy group, an aryloxy group, a hydroxyl group, a fluorine atom, a chlorine atom, an amino or substituted amino group, a piperidino group, a morpholino group, a pyrrolidino group, a 1,2,3,6-tetrahydropyridino group, a 4-[3-azabicyclo(3,2,2)-nonyl] group, or a 4-(piperazin-1-yl) or 4-(4-substituted-piperazin-1-yl) group of the formula SPC2 In which R=H, lower alkyl or 1-5 carbon atoms, aryl, substituted aryl, aralkyl, cinnamyl, acyl, ethoxy-carbonyl, aroyl or substituted aroyl and n is an integer from 1 to 5 except that when n is 1 X is not an alkyl group of 1 to 3 carbon atoms or an alkoxy group of 1 or 2 carbon atoms or a chlorine atom in the 4'-position, or an amino or acylated amino group in positions 2', 3' or 4'; and when n = 2 the groups X cannot both be methyl or both be methoxy in the 2' and 5' positions, nor can X be a chlorine atom in both the 2' and 4' positions or the 3' and 4' positions, and when n = 3, X cannot all three be methoxy. These compounds have anti-hypertensive activity.