3,4,5-Trifluorobenzoic acid

3,4,5-Trifluorobenzoic acid Basic information
Product Name:3,4,5-Trifluorobenzoic acid
Synonyms:3,4,5-TRIFLUOROBENZOIC ACID;3-flurobenzenenitrile;3,4,5-Trifluorobenzoic;3,4,5-Trifluorobenzoic acid 98%;3,4,5-Trifluorobenzoicacid98%;BUTTPARK 30\01-46;RARECHEM AL BO 0682;Benzoic acid, 3,4,5-trifluoro-
CAS:121602-93-5
MF:C7H3F3O2
MW:176.09
EINECS:624-063-4
Product Categories:Fluorine series;C7;Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts;Aromatic Nitriles;Carbonyl Compounds;Carboxylic Acids;Benzoic acid;Fluorobenzoic acids
Mol File:121602-93-5.mol
3,4,5-Trifluorobenzoic acid Structure
3,4,5-Trifluorobenzoic acid Chemical Properties
Melting point 97-99 °C (lit.)
Boiling point 116-118C/100Torr
density 1,12g/cm
refractive index 1,471-1,473
storage temp. Sealed in dry,Room Temperature
pka3.46±0.10(Predicted)
form powder to crystal
color White to Almost white
BRN 7476737
InChIKeyVJMYKESYFHYUEQ-UHFFFAOYSA-N
CAS DataBase Reference121602-93-5(CAS DataBase Reference)
EPA Substance Registry SystemBenzoic acid, 3,4,5-trifluoro- (121602-93-5)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-37/39-36
WGK Germany 3
HazardClass IRRITANT
HS Code 29163990
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
ALFA English
3,4,5-Trifluorobenzoic acid Usage And Synthesis
Chemical Propertieswhite to light yellow crystal powder
Uses3,4,5-Trifluorobenzoic acid is an isomer of 2,3,6-Trifluorobenzoic acid (T790050), and both are deriatives of Benzoic acid (B203900). 3,4,5-Trifluorobenzoic acid is also part of a group of compounds that have potential inhibitory activity towards d-amino acid oxidases, deeming them capable of treating mental disorders such as schizophrenia.
Uses3,4,5-Trifluorobenzoic acid may be used in chemical synthesis.
3,4,5-Trifluorobenzoic acid Preparation Products And Raw materials
Preparation Products3,5-DIFLUORO-4-METHOXYBENZOIC ACID-->2,6-Difluorophenol-->4-Ethoxy-3,5-difluorobenzoicacid-->4-Benzyloxy-3,5-difluorobenzoic acid
4-N-HEPTYLBENZOIC ACID Methyl 3-(4-Methoxycarbonylphenyl)propionate 3-(4-CARBOXYPHENYL)PROPIONIC ACID 3-(Trifluoromethyl)benzoic acid 2,4,5-Trifluorobenzoic acid ALUMINUM FORMATE 4-OCTYLPHENYL 2-CHLORO-4-(4-HEPTYLBENZOYL-OXY)BENZOATE 2-(Trifluoromethyl)benzoic acid Triethyl orthoformate 2,3,4-Trifluorobenzoic acid 2,4-Difluorobenzoic acid Trimethoxymethane Trimesic acid 2,3,4-Trihydroxybenzoic acid 4-Pentylphenyl 4-propylbenzoate 4-N-PENTYLBENZOIC ACID 4'-N-BUTOXYPHENYL ESTER 3,4,5-Trifluorobenzoic acid 1,3,5-Trifluorobenzene

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