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RARECHEM AL BO 0356

2-chloro-5-(trifluoromethyl)benzoic acid

CAS: 657-06-7

Molecular Formula: C8H4ClF3O2

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RARECHEM AL BO 0356 - Names and Identifiers

Name 2-chloro-5-(trifluoromethyl)benzoic acid
Synonyms RARECHEM AL BO 0356
TIMTEC-BB SBB003328
2-Chloro-5-trifluoromethylbenzoic acid
2-CHLORO-5-(TRIFLUOROMETHYL)BENZOIC ACID
2-chloro-5-(trifluoromethyl)benzoic acid
2-Chloro-5-(trifluoromethyl)benzoic acid
2-chloro-5-(trifluoromethoxy)benzoic acid
Benzoic acid, 2-chloro-5-(trifluoromethyl)-
3-Carboxy-4-chlorobenzotrifluoride, 6-Chloro-alpha,alpha,alpha-trifluoro-m-toluic acid
CAS 657-06-7
InChI InChI=1/C8H4ClF3O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14)
InChIKey WLXRKCGYQAKHSJ-UHFFFAOYSA-N

RARECHEM AL BO 0356 - Physico-chemical Properties

Molecular FormulaC8H4ClF3O2
Molar Mass224.56
Density1.523±0.06 g/cm3(Predicted)
Melting Point93-96 °C (lit.)
Boling Point270.4±40.0 °C(Predicted)
Flash Point117.3°C
Vapor Presure0.00338mmHg at 25°C
pKa2.45±0.25(Predicted)
Storage ConditionSealed in dry,Room Temperature
Refractive Index1.495

RARECHEM AL BO 0356 - Risk and Safety

Hazard SymbolsXi - Irritant
Irritant
Risk Codes36/37/38 - Irritating to eyes, respiratory system and skin.
Safety DescriptionS26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection.
S37 - Wear suitable gloves.
WGK Germany3
HS Code29163990
Hazard ClassIRRITANT

RARECHEM AL BO 0356 - Reference Information

Use 2-chloro-5-(trifluoromethyl) benzoic acid is an important intermediate of a new type of drug for the treatment of diabetes. In addition, it can also be used to synthesize heat shock protein inducers and non-steroidal anti-inflammatory drugs. As an important pharmaceutical intermediate, 2-chloro-5-(trifluoromethyl) benzoic acid also has an important application prospect in the research and development of new drugs.
preparation weigh the compounds p-chlorotrifluoromethylbenzene 18.1g(0.1mol) and tetramethylethylenediamine 11.6g(0.1mol) dissolved in 150ml of anhydrous tetrahydrofuran, and cool the reaction mixture to -75 ℃ with dry ice acetone bath. the reaction system is vacuumed for nitrogen protection. Under the protection of nitrogen, 77.0ml(0.1mol) of tert-butyl lithium (1.3M n-hexane solution) is extracted and placed in a constant pressure drop funnel, and then slowly added into the reaction system. When dropping, the reaction temperature does not exceed -70 ℃. After dropping, the reaction continues to stir for 1 hour, slowly pour the reaction solution on the surface of 50g of dry ice, continue to stir for 30 minutes, wait until the dry ice is volatilized, adjust the pH value to 4 with 30ml of 6N hydrochloric acid, continue to stir the reaction post-treatment solution at 5-10 ℃ for 5-6 hours, light yellow solid will be precipitated, filtered, washed with water, and vacuum dried at 40 ℃ to obtain 21.7g of light yellow crude product. Add 21.7g of crude product to 100ml of n-hexane solution, heat and reflux for 30 minutes, cool to room temperature, precipitate solids, and filter to obtain 20.61g of white crystalline refined product with a yield of 92%.
Last Update:2024-04-09 20:49:11
RARECHEM AL BO 0356
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SHANGHAI ACMEC BIOCHEMICAL TECHNOLOGY CO., LTD.
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SHANGHAI ACMEC BIOCHEMICAL TECHNOLOGY CO., LTD.
Spot supply
Product Name: 2-Chloro-5-trifluoromethylbenzoic acid Visit Supplier Webpage Request for quotation
CAS: 657-06-7
Tel: +86-400-900-4166
Email: product@acmec-e.com
Mobile: +86-18621343501
QQ: 2881950922 Click to send a QQ message
Wechat: 18621343501
WhatsApp: +86-18621343501
Shanghai Macklin Biochemical Co., Ltd
Spot supply
Product Name: 2-Chloro-5-(trifluoromethyl)benzoic acid Visit Supplier Webpage Request for quotation
CAS: 657-06-7
Tel: +86-18821248368
Email: Int06@meryer.com
Mobile: +86-18821248368
QQ: 495145328 Click to send a QQ message
WhatsApp: +86-18821248368
Shanghai Yuanye Bio-Technology Co., Ltd.
Product Name: 2-Chloro-5-(Trifluoromethyl)Benzoic Acid Visit Supplier Webpage Request for quotation
CAS: 657-06-7
Tel: 18301782025
Email: 3008007409@qq.com
Mobile: 18021002903
QQ: 3008007409 Click to send a QQ message
Shanghai Worldyang Chemical Co.,Ltd.
Product Name: 2-chloro-5-(trifluoromethyl)benzoic acid Request for quotation
CAS: 657-06-7
Tel: +86-21-56795779
Email: charles7788@worldyachem.com
Mobile: +86-13651600618
QQ: 2850607228 Click to send a QQ message
Wechat: +8613651600618
WhatsApp: +8613651600618
View History
RARECHEM AL BO 0356
GAMMA-PHENYL-N-BUTYRIC ACID
N-ACETYL-E-CAPROLACTAM
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