Fomesafen - analytical standard, ≥99.5% , CAS No.72178-02-0

CAS: 72178-02-0 Cat. No.: F109950 Formula: C15H10ClF3N2O6S Peso molecolare: 438.76 Beilstein Registry Number: 8165046 Numero EC: 276-439-9
Disponibile su ordine
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. ≥99.5%
Synonyms
5-(2chloro-4-trifluoromethylphenoxy)-2-nitro-N-methansulphonyl benzamide | KS-5045 | 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-N-methanesulfonyl benzamide | DTXCID704112 | Fomesafen 10 microg/mL in Acetonitrile | NCGC00163908-03 | SCHEMBL16881788 |
Storage
Room temperature
Shipped In
Normal
★
Size
Germania (EU)
USA*
Price
Qty
100mg
F109950-100mg
—
3 Disponibile
91,89€
500mg
F109950-500mg
—
3 Disponibile
289,74€
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Why this grade

analytical standard, ≥99.5% Standard analitico for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 11 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinonimi
5-(2chloro-4-trifluoromethylphenoxy)-2-nitro-N-methansulphonyl benzamide | KS-5045 | 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-N-methanesulfonyl benzamide | DTXCID704112 | Fomesafen 10 microg/mL in Acetonitrile | NCGC00163908-03 | SCHEMBL16881788 |
Specifiche e purezza
analytical standard, ≥99.5%
Condizioni di conservazione di stoccaggio
Room temperature
Spedito in
Normal
Grado
Standard analitico
Purezza
≥99.5%
Nomi e identificatori
Pubchem Sid508813955
Sorrisi canoniciCS(=O)(=O)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]
IUPAC Name5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitrobenzamide
InChIKeyBGZZWXTVIYUUEY-UHFFFAOYSA-N
INCHI1S/C15H10ClF3N2O6S/c1-28(25,26)20-14(22)10-7-9(3-4-12(10)21(23)24)27-13-5-2-8(6-11(13)16)15(17,18)19/h2-7H,1H3,(H,20,22)
Isomeri SMILES CS(=O)(=O)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]
WGK Germania 1
RTECS CV2475000
Peso molecolare 438.76
Beilstein 8165046
Reaxy-Rn 8165046
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8165046&ln=

Documentazione

📋 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

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassDiphenylethers
Intermediate Tree Nodes Not available
Direct ParentDiphenylethers
Alternative Parents Diarylethers  Trifluoromethylbenzenes  Nitrobenzenes  Nitroaromatic compounds  Phenol ethers  Phenoxy compounds  Chlorobenzenes  Aryl chlorides  Sulfonyls  Organosulfonic acids and derivatives  Organic oxoazanium compounds  Propargyl-type 1,3-dipolar organic compounds  Organopnictogen compounds  Organonitrogen compounds  Organofluorides  Organochlorides  Organic zwitterions  Organic oxides  Alkyl fluorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Diphenylether - Diaryl ether - Trifluoromethylbenzene - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Ether - Organic oxoazanium - Organic zwitterion - Organofluoride - Organochloride - Organonitrogen compound - Organohalogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Aromatic homomonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.
External Descriptors Amide herbicides
Struttura 3D
Modello di struttura chimica interattiva





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Meccanismi d'azione
Certificati (CoA, COO, BSE/TSE e tabella di analisi)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot NumberCertificate TypeDataOggetto
K2321429Certificate of AnalysisAug 12, 2025 F109950
K2322042Certificate of AnalysisAug 12, 2025 F109950
G2103095Certificate of AnalysisApr 12, 2023 F109950
Proprietà chimiche e fisiche
Peso molecolare438.800 g/mol
XLogP32.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Exact Mass437.99 Da
Monoisotopic Mass437.99 Da
Topological Polar Surface Area127.000 Ų
Heavy Atom Count28
Formal Charge0
Complexity693.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Riferimenti
1. Ning Yue, Jiangjiexing Wu, Wei Qi, Rongxin Su.  (2023)  Algae-derived biochar nanozyme array for discrimination and detection of multiple pesticides in soil, water and food.  FOOD CHEMISTRY,      [PMID:37976876] [10.1016/j.foodchem.2023.137946]
2. Guoqiang Zhao, Jing Zhou, Yanning Tian, Qifeng Chen, Dongmei Mao, Jianchun Zhu, Xing Huang.  (2023)  Remediation of fomesafen contaminated soil by Bacillus sp. Za: Degradation pathway, community structure and bioenhanced remediation.  ENVIRONMENTAL POLLUTION,      [PMID:37634569] [10.1016/j.envpol.2023.122460]
3. Xue Dong, Leng Wang, Ruirui Feng, Zhaoyang Ren, Li Zhang, Huizhe Lu.  (2019)  Insights into the binding mechanism of a model protein with fomesafen: Spectroscopic studies, thermodynamics and molecular modeling exploration.  JOURNAL OF MOLECULAR STRUCTURE,      [PMID:] [10.1016/j.molstruc.2019.05.128]
4. Yanfang Zhao, Lubin Xu.  (2018)  Dispersive solid-phase extraction based on mesoporous melamine-formaldehyde polymer for sensitive determination of five chlorinated herbicides residues in water by high-performance liquid chromatography.  INTERNATIONAL JOURNAL OF ENVIRONMENTAL ANALYTICAL CHEMISTRY,      [PMID:] [10.1080/03067319.2018.1548618]
5. Ma Rong, Yu Shuangshuang, Li Yafang, Lin Yan, Ma Xiaodong.  (2024)  Enhancing the efficiency of polypyrrole-dodecylbenzene sulfonic acid in-tube solid-phase microextraction coating for analysis of nitrogen-containing pesticides in water environments.  Frontiers in Environmental Science,      [PMID:] [10.3389/fenvs.2024.1350170]
6. Zhimin Liu, Weijun Wang, Yibo Geng, Yuting Zhang, Xuan Gao, Junfeng Xu, Xiaolu Liu.  (2024)  Integrating automated machine learning and metabolic reprogramming for the identification of microplastic in soil: A case study on soybean.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:39186842] [10.1016/j.jhazmat.2024.135555]
7. Ning Yue, Yifan Lai, Jiangjiexing Wu, Qiaochu Zhang, Wei Qi, Rongxin Su.  (2024)  Optimization of metal–organic framework nanozyme activity via histidine modification for simultaneous pesticide detection.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2024.152630]
8. Jiale Lin, Cai Shen, Yongfa Cheng, Oi-Ming Lai, Chin-Ping Tan, Worawan Panpipat, Ling-Zhi Cheong.  (2024)  Thermo-Switchable Enzyme@Metal–Organic Framework for Selective Biocatalysis and Biosensing.  ACS Applied Materials & Interfaces,      [PMID:39052986] [10.1021/acsami.4c05208]
9. Kuo Liu, Yulin Wu, Lining Zheng, Xian Wu, Hao Zhang.  (2025)  Regulatory mechanism of Acidovorax temperans LK1 on the combined pollution of fomesafen and lead.  Journal of Environmental Chemical Engineering,      [PMID:] [10.1016/j.jece.2025.118583]
10. Yifan Lai, Xuejiao J. Gao, Zhenxiang Li, Yuxin Wan, Ning Yue, Weili Zhang, Xin Zhao, Rongxin Su, Xing Lu, Jiangjiexing Wu.  (2026)  Engineering the Activity-Selectivity Balance in Biomimetic MOF Nanozymes via Amino Acid-Induced Pore Confinement.  ADVANCED FUNCTIONAL MATERIALS,      [PMID:] [10.1002/adfm.77029]
11. Xuehui Chen, Xianzhao Zhang, Fengmao Liu, Yufei Dong.  (2026)  Degradation of fomesafen in water by sodium persulfate activated with hydrochar optimized using deep eutectic solvent.  Sustainable Chemistry and Pharmacy,      [PMID:] [10.1016/j.scp.2026.102492]
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