3,5-Bis(trifluoromethyl)benzoic acid
- CAS No.
- 725-89-3
- Chemical Name:
- 3,5-Bis(trifluoromethyl)benzoic acid
- Synonyms
- 3,5-DI(TRIFLUOROMETHYL)BENZOIC ACID;MBT-BOA;RARECHEM AL BO 0001;TIMTEC-BB SBB000963;3,5-Di-(Trifluoromethyl)Benzoi;3,5-Bis(trifluoromethyl)benzoic;3,5-bis(trifluoromethyl)-benzoicaci;BIS(3,5-TRIFLUOROMETHYL)BENZOIC ACID;3,5-BIS(TRIFLUOROMETHYL)BENZOIC ACID;3, 5-Bis (trifluoromrthyl) benzoic acid
- CBNumber:
- CB0255912
- Molecular Formula:
- C9H4F6O2
- Molecular Weight:
- 258.12
- MDL Number:
- MFCD00000388
- MOL File:
- 725-89-3.mol
- MSDS File:
- SDS
Melting point | 142-143 °C(lit.) |
---|---|
Boiling point | 223.9±40.0 °C(Predicted) |
Density | 1,42 g/cm3 |
storage temp. | Sealed in dry,Room Temperature |
solubility | DMSO, Methanol |
form | Solid |
pka | 3.34±0.10(Predicted) |
color | White to Off-White |
Water Solubility | Slightly soluble in water. |
BRN | 2058600 |
InChI | InChI=1S/C9H4F6O2/c10-8(11,12)5-1-4(7(16)17)2-6(3-5)9(13,14)15/h1-3H,(H,16,17) |
InChIKey | HVFQJWGYVXKLTE-UHFFFAOYSA-N |
SMILES | C(O)(=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1 |
CAS DataBase Reference | 725-89-3(CAS DataBase Reference) |
EWG's Food Scores | 1 |
FDA UNII | NN52L84T3A |
NIST Chemistry Reference | 3,5-Bis(trifluoromethyl)benzoic acid(725-89-3) |
SAFETY
Risk and Safety Statements
Symbol(GHS) | ![]() GHS07 |
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Signal word | Warning | |||||||||
Hazard statements | H315-H319-H335 | |||||||||
Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 | |||||||||
Hazard Codes | Xi | |||||||||
Risk Statements | 36/37/38 | |||||||||
Safety Statements | 26-36-37/39 | |||||||||
WGK Germany | 3 | |||||||||
RTECS | DG4448020 | |||||||||
HazardClass | IRRITANT | |||||||||
HS Code | 29163990 | |||||||||
NFPA 704 |
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3,5-Bis(trifluoromethyl)benzoic acid price More Price(39)
Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
---|---|---|---|---|---|---|---|
Sigma-Aldrich | 232882 | 3,5-Bis(trifluoromethyl)benzoic acid 98% | 725-89-3 | 5g | $36.4 | 2024-03-01 | Buy |
Sigma-Aldrich | 232882 | 3,5-Bis(trifluoromethyl)benzoic acid 98% | 725-89-3 | 25g | $142 | 2024-03-01 | Buy |
TCI Chemical | B1420 | 3,5-Bis(trifluoromethyl)benzoic Acid >98.0%(GC)(T) | 725-89-3 | 25g | $149 | 2024-03-01 | Buy |
Alfa Aesar | A11325 | 3,5-Bis(trifluoromethyl)benzoic acid, 98% | 725-89-3 | 5g | $49.65 | 2024-03-01 | Buy |
Alfa Aesar | A11325 | 3,5-Bis(trifluoromethyl)benzoic acid, 98% | 725-89-3 | 25g | $150.65 | 2024-03-01 | Buy |
3,5-Bis(trifluoromethyl)benzoic acid Chemical Properties,Uses,Production
Chemical Properties
white to light yellow crystal powder
Uses
3,5-Bis(trifluoromethyl)benzoic acid is a useful synthetic intermediate, and is a derivative of Benzoic acid (B203900). 3,5-Bis(trifluoromethyl)benzoic acid has also been identified as a major metabolite of a series of 3,5-bis(trifluoromethyl)benzyl ethers in vitro, and is hypothesized to result via oxidation of the benzylic position.
Application
3,5-bis(trifluoromethyl)benzoic acid is an intermediate in synthesizing pharmaceutical compounds, which are substance P (neurokinin-1) receptor antagonists. In particular, such compounds are substance P (neurokinin-1) receptor antagonists, which are helpful, e.g., in treating inflammatory diseases, psychiatric disorders, and emesis.
Synthesis Reference(s)
The Journal of Organic Chemistry, 68, p. 3695, 2003 DOI: 10.1021/jo026903n
General Description
3,5-Bis(trifluoromethyl)benzoic acid is a significant metabolite formed during metabolism of 3,5-bis(trifluoromethyl)benzyl ether via oxidation.
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3,5-Bis(trifluoromethyl)benzoic acid Preparation Products And Raw materials
Raw materials
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Preparation Products
Supplier | Tel | Country | ProdList | Advantage | |
---|---|---|---|---|---|
Shanghai Xinchem Co., Ltd. | +86-021-34123252 +8618049800532 | xinchem@xinchem.com | China | 49 | 58 |
Qingdao Yonghefeng Economic and Trade Co., Ltd. | +86-13375559818 +86-13375559818 | cfy69@163.com | China | 195 | 58 |
Enki Biopharmaceuticals (Shanghai) Limited | +86-0086-2157680326 +8613916707528 | yusu@enkibiopharma.com | China | 46 | 58 |
Hebei Mojin Biotechnology Co., Ltd | +8613288715578 | sales@hbmojin.com | China | 12450 | 58 |
Capot Chemical Co.,Ltd. | 571-85586718 +8613336195806 | sales@capotchem.com | China | 29798 | 60 |
Shanghai Daken Advanced Materials Co.,Ltd | +86-371-66670886 | info@dakenam.com | China | 16914 | 58 |
Beijing Cooperate Pharmaceutical Co.,Ltd | 010-60279497 | sales01@cooperate-pharm.com | CHINA | 1811 | 55 |
ATK CHEMICAL COMPANY LIMITED | +undefined-21-51877795 | ivan@atkchemical.com | China | 32760 | 60 |
Speranza Chemical Co., Ltd. | +86-86-075521030354 +8618688942810 | sophieliu@speranzachem.com | China | 801 | 55 |
career henan chemical co | +86-0371-86658258 +8613203830695 | sales@coreychem.com | China | 29894 | 58 |
Related articles
- The specific synthesis method of 3,5-bis(trifluoromethyl)benzoic acid
- ?3,5-bis(trifluoromethyl)benzoic acid is an intermediate in synthesizing compounds with pharmacological activity.
- Jul 12,2024
View Lastest Price from 3,5-Bis(trifluoromethyl)benzoic acid manufacturers
Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
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2024-08-23 | 3,5-bis(Trifluoromethyl)benzoic acid
725-89-3
|
US $130.00 / KG | 1KG | 99% | 300MT/year | Speranza Chemical Co., Ltd. | |
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2024-08-19 | 3,5-Bis(trifluoromethyl)benzoic acid
725-89-3
|
US $0.00-0.00 / kg | 1kg | 99.0%HPLC | 30000 | Enki Biopharmaceuticals (Shanghai) Limited | |
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2023-10-22 | 3,5-Bis(trifluoromethyl)benzoic acid
725-89-3
|
US $0.00-0.00 / drums | 1drums | 99%min. | 10tons | Shanghai Xinchem Co., Ltd. |
-
- 3,5-bis(Trifluoromethyl)benzoic acid
725-89-3
- US $130.00 / KG
- 99%
- Speranza Chemical Co., Ltd.
-
- 3,5-Bis(trifluoromethyl)benzoic acid
725-89-3
- US $0.00-0.00 / kg
- 99.0%HPLC
- Enki Biopharmaceuticals (Shanghai) Limited
-
- 3,5-Bis(trifluoromethyl)benzoic acid
725-89-3
- US $0.00-0.00 / drums
- 99%min.
- Shanghai Xinchem Co., Ltd.
3,5-Bis(trifluoromethyl)benzoic acid Spectrum
725-89-3(3,5-Bis(trifluoromethyl)benzoic acid)Related Search:
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