69056-67-3

Basic information

• Product Name: 3-(TRIFLUOROMETHYL)CROTONIC ACID
• Synonyms: BETA-TRIFLUOROMETHYLCROTONIC ACID;4,4,4-TRIFLUORO-3-METHYL-2-BUTENOIC ACID;3-(TRIFLUOROMETHYL)CROTONIC ACID;3-(TRIFLUOROMETHYL)BUT-2-EN-1-OIC ACID;3-(Trifluoromethyl)but-2-enoic acid, 4,4,4-Trifluoro-3-methylbut-2-enoic acid
• CAS NO: 69056-67-3
• Molecular Formula: C₅H₅F₃O₂
• Molecular Weight: 154.09
• Mol File: 69056-67-3.mol
• Article Data: 1

Chemical Properties

• Melting Point: 28-30 °C(lit.)
• Boiling Point: 158-163 °C(lit.)
• Flash Point: 175 °F
• Appearance: /
• Density: 1.318 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.0507mmHg at 25°C
• Refractive Index: 1.3850
• PKA: 3.59±0.33(Predicted)
• BRN: 1769204
• CAS DataBase Reference: 3-(TRIFLUOROMETHYL)CROTONIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(TRIFLUOROMETHYL)CROTONIC ACID(69056-67-3)
• EPA Substance Registry System: 3-(TRIFLUOROMETHYL)CROTONIC ACID(69056-67-3)

Safety Data

• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-27-36/37/39-45
• RIDADR: UN 3261 8/PG 3
• WGK Germany: 3
• HazardClass: 8
• PackingGroup: II
• Hazardous Substances Data: 69056-67-3(Hazardous Substances Data)

Usage

General Description

3-(Trifluoromethyl)crotonic acid is a chemical compound with the molecular formula C5H5F3O2. It is a carboxylic acid derivative with a trifluoromethyl group attached to the crotonic acid structure. 3-(TRIFLUOROMETHYL)CROTONIC ACID is used in the synthesis of pharmaceuticals and agrochemicals, as well as in the study of organic reactions and chemical processes. It is also used as a building block in the production of other chemicals. 3-(Trifluoromethyl)crotonic acid is considered to be a valuable intermediate in organic synthesis and has various potential applications in the field of medicinal chemistry and materials science.

InChI:InChI=1/C5H5F3O2/c1-3(2-4(9)10)5(6,7)8/h2H,1H3,(H,9,10)/b3-2-

Upstream product

• 110115-54-3 4-methyl-4-trifluoromethyl-oxetan-2-one 
• 671-82-9 β-trifluoromethylcrotonic acid methyl ester 
• 338-03-4 4,4,4-trifluoro-3-hydroxy-3-methyl-butanoic acid 

Downstream Products

• 348-75-4 (-)-3-trifluoromethylbutanoic acid 
• 64750-89-6 4,4,4-Trifluor-3-methyl-2-butensaeure-ethylester 
• 339-62-8 (+/-)-4,4,4-Trifluor-3-methyl-1-butanol 
• 649-56-9 3-Methoxy-3-trifluormethyl-buttersaeure-methylester 
• 675618-07-2 4-(trifluoromethyl)-6-[4-(methylthio)phenyl]-2-pyridone 
• 918295-05-3 N-[(1S,2R)-2-hydroxy-3-[[(4-methoxyphenyl)sulfonyl][2-methylpropyl]amino]-1-(phenylmethyl)propyl]-3-methyl-4,4,4-trifluoro-2-butenamide 
• 10102-92-8 (E,Z)-4,4,4-trifluoro-3-methyl-1-phenyl-2-buten-1-one 
• 1408236-69-0 4,4,4-trifluoro-3-methyl-1-p-tolyl-2-buten-1-one 
• 1408236-71-4 4,4,4-trifluoro-1-(4-fluorophenyl)-3-methyl-2-buten-1-one 
• 1408236-72-5 4,4,4-trifluoro-1-(4-chlorophenyl)-3-methyl-2-buten-1-one 
• 1408236-70-3 4,4,4-trifluoro-1-(3,4-dimethylphenyl)-3-methyl-2-buten-1-one 
• 1408236-73-6 4,4,4-trifluoro-1-(4-hydroxyphenyl)-3-methyl-2-buten-1-one 
• 1408236-76-9 C₁₁H₉F₃O₂ 

Relevant articles and documents

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