ChemicalBook > CAS DataBase List > 2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID

2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID

Product Name: 2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID
CAS No.: 115029-23-7
Chemical Name: 2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID
Synonyms: RARECHEM AL BO 0633;2-Fluoro-5-trifluoromethylbenz;à,à,à,6-tetrafluoro-m-toluic acid;2-fluoro-5-(trifluoromethyl)benzoic;2-FLUORO-5-TRIFLUOROMETHYLBENZIOC ACID;2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID;2-Fluoro-5-(trifluoromethyl)benzoicacid98%;2-Fluoro-5-(trifluoromethyl)benzoicAcid>Benzoic acid, 2-fluoro-5-(trifluoromethyl)-;2-Fluoro-5-(trifluoromethyl)benzoic acid 98%
CBNumber: CB9397309
Molecular Formula: C8H4F4O2
Formula Weight: 208.11
MOL File: 115029-23-7.mol

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2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID Property

Melting point:: 100-103 °C (lit.)
Boiling point:: 236℃
Density: 1.489
Flash point:: 96℃
storage temp.: Sealed in dry,Room Temperature
solubility: Chloroform (Slightly), DMSO (Slightly), Ethyl Acetate (Slightly),
pka: 2.84±0.10(Predicted)
form: Solid
color: Off-White to Pale Beige
BRN: 5813056
InChI: InChI=1S/C8H4F4O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14)
InChIKey: LIFKXWNFWIUMJT-UHFFFAOYSA-N
SMILES: C(O)(=O)C1=CC(C(F)(F)F)=CC=C1F
CAS DataBase Reference: 115029-23-7(CAS DataBase Reference)

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Safety

Hazard Codes: Xi
Risk Statements: 36/37/38
Safety Statements: 26-37/39
WGK Germany: 3
HazardClass: IRRITANT
HS Code: 29163990

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P271Use only outdoors or in a well-ventilated area.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

Sigma-Aldrich

Product number: 455253
Product name: 2-Fluoro-5-(trifluoromethyl)benzoic acid
Purity: 98%
Packaging: 5g
Price: $50.6
Updated: 2023/06/20

TCI Chemical

Product number: F0620
Product name: 2-Fluoro-5-(trifluoromethyl)benzoic Acid
Purity: >98.0%(GC)(T)
Packaging: 1g
Price: $28
Updated: 2025/07/31

TCI Chemical

Product number: F0620
Product name: 2-Fluoro-5-(trifluoromethyl)benzoic Acid
Purity: >98.0%(GC)(T)
Packaging: 5g
Price: $80
Updated: 2025/07/31

TRC

Product number: F598475
Product name: 2-Fluoro-5-(trifluoromethyl)benzoic Acid
Packaging: 1g
Price: $70
Updated: 2021/12/16

AK Scientific

Product number: A997
Product name: 2-Fluoro-5-(trifluoromethyl)benzoic Acid
Packaging: 25g
Price: $87
Updated: 2021/12/16

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2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID Chemical Properties,Usage,Production

Chemical Properties

White to off-white powder

Synthesis Reference(s)

Tetrahedron Letters, 33, p. 7495, 1992 DOI: 10.1016/S0040-4039(00)60805-5

Synthesis

402-44-8

115029-23-7

General procedure for the synthesis of 2-fluoro-5-trifluoromethylbenzoic acid from 4-fluorobenzotrifluoride: 99 g (0.6 mol) of 4-fluorobenzotrifluoride was dissolved in 750 ml of tetrahydrofuran at -60 °C and protected by nitrogen, and 256 ml (0.64 mol) of a 2.5 M butyl lithium hexane solution was added slowly dropwise over a controlled period of time. The reaction mixture was stirred continuously at -60 °C to -70 °C for 4 h and subsequently poured into a large excess of dry ice. after 15 min, the excess dry ice was evaporated by external heating and the solvent was removed by rotary evaporator. The residue was dissolved in 500 ml of water, 30 ml of 1N sodium hydroxide solution was added and washed with 2 x 300 ml of ethyl acetate. The aqueous phase was acidified with concentrated hydrochloric acid and then extracted with 2 x 300 ml ethyl acetate. The organic phases were combined and washed sequentially with 500 ml of water and 300 ml of saturated saline, dried over anhydrous sodium sulfate and concentrated by rotary evaporation. The crude product was recrystallized by hexane to give 80 g of white analytically pure crystals with 64% yield and melting point of 205°C. The product was extracted with 500 ml of water and 300 ml of saturated saline. Elemental analysis results (C8H4O2F4): calculated value C 46.17%, H 1.94%; measured value C 46.16%, H 1.89%.

References

[1] Patent: US4705853, 1987, A
[2] Patent: US5304532, 1994, A

2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID Preparation Products And Raw materials

Raw materials

Hexane Sodium sulfate Sodium chloride 4-Fluorobenzotrifluoride Carbon dioxide Tetrahydrofuran Ethyl acetate Sodium hydroxide n-Butyllithium

Preparation Products

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2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID Suppliers

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View Lastest Price from 2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID manufacturers

Speranza Chemical Co., Ltd.

Product: 2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID 115029-23-7
Price: US $420.00/KG
Min. Order: 1KG
Purity: 98%
Supply Ability: 20 tons
Release date: 2019-12-24

Henan Aochuang Chemical Co.,Ltd.

Product: 2-Fluoro-5-Trifluoromethylbenzoic Acid 115029-23-7
Price: US $0.00-0.00/kg
Min. Order: 1kg
Purity: 98%
Supply Ability: 1Ton
Release date: 2022-10-14

Career Henan Chemical Co

Product: 2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID 115029-23-7
Price: US $8.80/KG
Min. Order: 1KG
Purity: 97%-99%
Supply Ability: 100kg
Release date: 2019-07-12

115029-23-7, 2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACIDRelated Search:

RARECHEM AL BO 0633

2-FLUORO-5-TRIFLUOROMETHYLBENZIOC ACID

2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID

2-Fluoro-5-trifluoromethylbenz

à,à,à,6-tetrafluoro-m-toluic acid

2-Fluoro-5-(trifluoromethyl)benzoic acid 98%

2-Fluoro-5-(trifluoromethyl)benzoicacid98%

2-FLUORO-5-(TRIFLUOROMETHYL)BENZOIC ACID, 96+%

alpha,alpha,alpha,6-Tetrafluoro-m-toluic acid

alpha,alpha,alpha,6-Tetrafluoro-m-toluic acid, 3-Carboxy-4-fluorobenzotrifluoride

2-fluoro-5-(trifluoromethyl)benzoic

2-Fluoro-5-(trifluoromethyl)benzoicAcid&gt

Benzoic acid, 2-fluoro-5-(trifluoromethyl)-

115029-23-7

115029-25-7

C8H4O2F4

Building Blocks

Carboxylic Acids

Carbonyl Compounds

CARBOXYLIC ACID

Organic Building Blocks

Fluorine series

Carbonyl Compounds

Carboxylic Acids

Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts