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≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Protected from light,Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 16 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488189995 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488189995 |
| Canonical Smiles | C1=CC(=C(C=C1C(F)(F)F)O)F |
| IUPAC Name | 2-fluoro-5-(trifluoromethyl)phenol |
| InChIKey | MCOSBFKOUQAIJS-UHFFFAOYSA-N |
| INCHI | 1S/C7H4F4O/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3,12H |
| Isomeric SMILES | C1=CC(=C(C=C1C(F)(F)F)O)F |
| WGK Germany | 3 |
| Molecular Weight | 180.1 |
| Beilstein | 8392138 |
| Reaxy-Rn | 8392138 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8392138&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Trifluoromethylbenzenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Trifluoromethylbenzenes |
| Alternative Parents | O-fluorophenols Fluorobenzenes 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Aryl fluorides Organooxygen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Trifluoromethylbenzene - 2-halophenol - 2-fluorophenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Alkyl fluoride - Organohalogen compound - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alkyl halide - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Feb 07, 2023 | F122602 | |
| Certificate of Analysis | Feb 07, 2023 | F122602 | |
| Certificate of Analysis | Oct 09, 2022 | F122602 | |
| Certificate of Analysis | Oct 09, 2022 | F122602 |
| Sensitivity | Air Sensitive |
|---|---|
| Refractive Index | 1.439 |
| Flash Point(°F) | 134.6 °F |
| Flash Point(°C) | 57°C(Lit.) |
| Boil Point(°C) | 146°C |
| Molecular Weight | 180.100 g/mol |
| XLogP3 | 2.600 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 0 |
| Exact Mass | 180.02 Da |
| Monoisotopic Mass | 180.02 Da |
| Topological Polar Surface Area | 20.200 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 156.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Jizhong Wu, Wenya Wei, Muhammad Zareef, Shuhua Li, Qin Ouyang, Quansheng Chen. (2023) Simple design of upconversion nanoparticles-based aptasensor integrated microfluidic chip for ultra-sensitive detection of bisphenol A in aquatic products. SENSORS AND ACTUATORS B-CHEMICAL, [PMID:] [10.1016/j.snb.2023.134017] |
| 2. Haoyu Long, Yanhao Jiang, Yanjuan Liu, Yuefei Zhang, Wei Chen, Sheng Tang. (2023) Chromatographic separation performance of silica microspheres surface-modified with triazine-containing imine-linked covalent organic frameworks. TALANTA, [PMID:37126925] [10.1016/j.talanta.2023.124589] |
| 3. Yukun Yang, Xiaoxing Zeng, Yu Tian, Xiaomin Wang, Xu Jing, Ligang Yu, Baoqing Bai, Jinhua Zhang, Shu Qin. (2023) A universal design of turn-on fluorescent aptasensor based on luminescent MOFs: Application for the detection of bisphenol A in water, milk and chicken samples. FOOD CHEMISTRY, [PMID:37137241] [10.1016/j.foodchem.2023.136167] |
| 4. Zhefei Hu, Yanhao Jiang, Panpan Cao, Yanjuan Liu, Yuefei Zhang, Wei Chen, Sheng Tang. (2023) Performance evaluation of 2-undecylimidazole/propyl methacrylate bifunctional silica gel for mixed-mode reversed-phase/anion-exchange chromatography. MICROCHEMICAL JOURNAL, [PMID:] [10.1016/j.microc.2023.108768] |
| 5. Qingying Wang, Lianfang Chen, Xiaoyan Cui, Jie Zhang, Yaohui Wang, Xiupei Yang. (2023) Determination of trace bisphenols in milk based on Fe3O4@NH2-MIL-88(Fe)@TpPa magnetic solid-phase extraction coupled with HPLC. TALANTA, [PMID:36657241] [10.1016/j.talanta.2023.124268] |
| 6. Yan Wu, Panpan Cao, Yanhao Jiang, Yanjuan Liu, Yuefei Zhang, Wei Chen, Zhengwu Bai, Sheng Tang. (2022) Ingenious introduction of aminopropylimidazole to tune the hydrophobic selectivity of dodecyl-bonded stationary phase for environmental organic pollutants. MICROCHEMICAL JOURNAL, [PMID:] [10.1016/j.microc.2022.107933] |
| 7. Chengjiang Zhang, Hongmei Yuan, Zeyi Lu, Yuhuang Li, Lirong Zhao, Zhuomin Zhang, Gongke Li. (2022) β-Ketoenamine-linked covalent organic framework absorbent for online micro-solid phase extraction of trace levels bisphenols in plastic samples. JOURNAL OF SEPARATION SCIENCE, 45 (9): (1493-1501). [PMID:35157355] [10.1002/jssc.202100905] |
| 8. Yan Wu, Kaixing Luo, Yanjuan Liu, Wei Chen, Zhengwu Bai, Sheng Tang. (2022) Innovative preparation of ureido/dodecyl dual-functionalized silica as a versatile mixed-mode stationary phase for high-resolution chromatographic separations. JOURNAL OF CHROMATOGRAPHY A, [PMID:35085896] [10.1016/j.chroma.2022.462834] |
| 9. Weiwei Ma, Shuangfeng Wan, Chenchen Lin, Xucong Lin, Zenghong Xie. (2020) Towards online specific recognition and sensitive analysis of bisphenol A by using AuNPs@aptamer hybrid-silica affinity monolithic column with LC-MS. TALANTA, [PMID:32887165] [10.1016/j.talanta.2020.121275] |
| 10. Sun Qianqian, Gao Chaohong, Ma Wende, He Yanting, Wu Jie, Luo Kailong, Ouyang Dan, Lin Zian, Cai Zongwei. (2020) High-throughput screening of bisphenols using magnetic covalent organic frameworks as a SELDI-TOF-MS probe. MICROCHIMICA ACTA, 187 (7): (1-11). [PMID:32504203] [10.1007/s00604-020-04340-5] |
| 11. Shuo Li, Huizhong Si, Jianshu Li, Mengtian Jia, Xiaohong Hou. (2020) Metal organic framework/chitosan foams functionalized with polyethylene oxide as a sorbent for enrichment and analysis of bisphenols in beverages and water. NEW JOURNAL OF CHEMISTRY, 44 (4): (1485-1492). [PMID:] [10.1039/C9NJ05196A] |
| 12. Yukun Yang, Xiaoyi Zhang, Xiaomin Wang, Xu Jing, Ligang Yu, Baoqing Bai, Tao Bo, Jinhua Zhang, Hailong Qian, Ying Gu. (2024) Self-powered molecularly imprinted photoelectrochemical sensor based on Ppy/QD/HOF heterojunction for the detection of bisphenol A. FOOD CHEMISTRY, [PMID:38277929] [10.1016/j.foodchem.2024.138499] |
| 13. Qidong Yu, Wenmin Zhang, Jingyi Wang, Shiye Xie, Baodi Liao, Hui Chen, Qingqing Ding, Lan Zhang. (2024) Thiocarbamide conversion-based nitrogen-rich covalent organic framework coatings for electro-enhanced solid-phase microextraction of bisphenols. JOURNAL OF CHROMATOGRAPHY A, [PMID:38763086] [10.1016/j.chroma.2024.465000] |
| 14. Kaixing Luo, Yu Luo, Yanjuan Liu, Yuefei Zhang, Wei Chen, Zhengwu Bai, Sheng Tang. (2022) Hydrophobic and hydrophilic selectivity of a multifunctional carbonyldiimidazolium/dodecyl modified silica stationary phase. JOURNAL OF CHROMATOGRAPHY A, [PMID:35810643] [10.1016/j.chroma.2022.463300] |
| 15. Ruifang Qi, Yue Zhao, Jinming Lei, Huixian Jia, Chenghong Feng. (2026) Nitro-electron trapping engineering for enhanced BPA degradation by metal free nitro-COFs. SEPARATION AND PURIFICATION TECHNOLOGY, [PMID:] [10.1016/j.seppur.2026.136975] |
| 16. Jinglin Chen, Xiaoying Feng, Tingting Tu, Chunying Wei, Yongsheng Cui, Juan Zheng, Gangfeng Ouyang. (2026) Modified biochar through synergistic strategies for enhanced extraction of bisphenol compounds in marine water. ANALYTICA CHIMICA ACTA, [PMID:] [10.1016/j.aca.2026.345372] |