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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-Nitro-3-(trifluoromethyl)phenol - ≥98% , CAS No.88-30-2
Synonyms
Phenol, m-trifluoromethyl-, p-nitro- | 2-trifiuoromethyl-4-hydroxynitrobenzene | NCGC00254809-01 | BRN 2053698 | m-Cresol, alpha,alpha,alpha-trifluoro-4-nitro- | DTXCID101788 | 4-Nitro-3-(trifluoromethyl)phenol, 99% (GC) | NCGC00164224-02 | m-Cresol, 4-ni
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
Phenol, m-trifluoromethyl-, p-nitro- | 2-trifiuoromethyl-4-hydroxynitrobenzene | NCGC00254809-01 | BRN 2053698 | m-Cresol, alpha, alpha, alpha-trifluoro-4-nitro- | DTXCID101788 | 4-Nitro-3-(trifluoromethyl)phenol, 99% (GC) | NCGC00164224-02 | m-Cresol, 4-ni
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 504751203 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504751203 Canonical Smiles C1=CC(=C(C=C1O)C(F)(F)F)[N+](=O)[O-] IUPAC Name 4-nitro-3-(trifluoromethyl)phenol InChIKey ZEFMBAFMCSYJOO-UHFFFAOYSA-N INCHI 1S/C7H4F3NO3/c8-7(9,10)5-3-4(12)1-2-6(5)11(13)14/h1-3,12H Isomeric SMILES C1=CC(=C(C=C1O)C(F)(F)F)[N+](=O)[O-] WGK Germany 3 RTECS GP3520000 Molecular Weight 207.11 Beilstein 2053698 Reaxy-Rn 2053698 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2053698&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Benzenoids Class Phenols Subclass Nitrophenols Intermediate Tree Nodes Not available Direct Parent Nitrophenols Alternative Parents Trifluoromethylbenzenes Nitrobenzenes Nitroaromatic compounds 1-hydroxy-2-unsubstituted benzenoids Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic homomonocyclic compounds Substituents Nitrophenol - Trifluoromethylbenzene - Nitrobenzene - Nitroaromatic compound - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - C-nitro compound - Organic nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Hydrocarbon derivative - Organohalogen compound - Alkyl fluoride - Organic oxide - Alkyl halide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as nitrophenols. These are compounds containing a nitrophenol moiety, which consists of a benzene ring bearing both a hydroxyl group and a nitro group on two different ring carbon atoms. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Soluble in Methanol Boil Point(°C) 135-138°C/0.01mmHg Melt Point(°C) 80 °C Molecular Weight 207.110 g/mol XLogP3 2.800 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 0 Exact Mass 207.014 Da Monoisotopic Mass 207.014 Da Topological Polar Surface Area 66.100 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 225.000 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
Citations of This Product References 1. Jinmao You, Kun Dou, Cuihua Song, Guoliang Li, Zhiwei Sun, Shijuan Zhang, Guang Chen, Xianen Zhao, Na Hu, Wu Zhou. (2017) 3-(2-Bromoacetamido)-N-(9-ethyl-9H)-carbazol fluorescent probe and its application for the determination of thiophenols in rubber products by HPLC with fluorescence detection and atmospheric chemical ionization mass spectrometry identification. JOURNAL OF SEPARATION SCIENCE, 40 (12): (2528-2540). [PMID:28371096 ] [10.1002/jssc.201601166 ] 2. Shuai Li, Hongyu Liu, Luojia Zheng, Chuntao Ma, Hailong Yu, Xiaodong Wu, Xiaobin Niu, Liping Wang. (2024) Electrolyte with weakly coordinating solvents for high-performance FeS2 cathode. Nano Energy, [PMID: [10.1016/j.nanoen.2024.110234 ]
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