Metalaxyl Solution in Hexane - in Hexane , CAS No.57837-19-1

CAS: 57837-19-1 Cat. No.: BWY396521 Molecular Weight: 279.33 Beilstein Registry Number: 2947777 EC Number: 260-979-7

24 Citations COA

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Metalaxyl Solution in Hexane - in Hexane CAS No(57837-19-1) by Aladdin Scientific

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AVAILABLE TO ORDER

GRADE & PURITY in Hexane

Synonyms

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Citations of This Product References Solution Calculators Reviews

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Why this grade

in Hexane for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C Ships Wet ice 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 24 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms

Specifications & Purity

in Hexane

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Names and Identifiers

Canonical Smiles	CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC
IUPAC Name	methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate
InChIKey	ZQEIXNIJLIKNTD-UHFFFAOYSA-N
INCHI	1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3
Isomeric SMILES	CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC
WGK Germany	2
RTECS	AY6910000
Molecular Weight	279.33
Beilstein	2947777
Reaxy-Rn	2947777
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2947777&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

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Amino acids, peptides, and analogues
      - Level5 Amino acids and derivatives
        Level6 Alpha amino acids and derivatives
        Level7 Alpha amino acid esters

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Amino acids, peptides, and analogues
Intermediate Tree Nodes	Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent	Alpha amino acid esters
Alternative Parents	Alanine and derivatives Anilides m-Xylenes Tertiary carboxylic acid amides Methyl esters Monocarboxylic acids and derivatives Dialkyl ethers Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Alpha-amino acid ester - Alanine or derivatives - Anilide - M-xylene - Xylene - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Methyl ester - Carboxylic acid ester - Carboxamide group - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors	ether - methyl ester - aromatic amide - alanine derivative - carboxamide
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. DOI: 10.1186/s13321-016-0174-y

3D Structure

Associated Targets(Human)

TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Globisporangium ultimum (223 Activities)

Flash Point(°F)	100 °C
Flash Point(°C)	100°C
Melt Point(°C)	71.8-72.3°C
Molecular Weight	279.330 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	279.147 Da
Monoisotopic Mass	279.147 Da
Topological Polar Surface Area	55.800 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	335.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

1. Bi Wang, Jingjing Yang, Xingzeng Zhao, Xu Feng, Shu Xu, Pirui Li, Linwei Li, Yu Chen. (2023) Antifungal activity of the botanical compound rhein against Phytophthora capsici and the underlying mechanisms. PEST MANAGEMENT SCIENCE, [PMID:37897133] [10.1002/ps.7852]
2. Fei Tong, Zan Yang, Zheng Wang, Wenya Liu, Wanqi Jiang, Lu Zhu, Lei Wang, Mingming Zheng, Ruyan Hou, Yibin Zhou, Yingnan Liu. (2023) Enzyme-mediated Ru@UiO-66@MnO2 NSs/thiamine-based ratiometric fluorescence sensor for visual detection of organophosphorus pesticide residues. FOOD CHEMISTRY, [PMID:37487398] [10.1016/j.foodchem.2023.136945]
3. Bi Wang, Guodong Zhang, Jingjing Yang, Linwei Li, Pirui Li, Shu Xu, Xu Feng, Yu Chen. (2023) Evaluation of Inhibitory Effect and Mechanism of Euphorbia Factor L3 against Phytophthora capsici. MOLECULES, 28 (7): (2958). [PMID:37049722] [10.3390/molecules28072958]
4. Yuhang Liu, Yi Zhang, Pran Gopal Karmaker, Yuting Tang, Lilei Zhang, Feng Huo, Ya Wang, Xiupei Yang. (2022) Dual-Color 2D Lead–Organic Framework with Two-Fold Interlocking Structures for the Detection of Nitrofuran Antibiotics and 2,6-Dichloro-4-nitroaniline. ACS Applied Materials & Interfaces, [PMID:36342338] [10.1021/acsami.2c15440]
5. Ying Wang, Fuyan Zhu, Li Yin, Guangxu Qu, Dik-Lung Ma, Chung-Hang Leung, Lihua Lu. (2022) Ratiometric fluorescent detection of pesticide based on split aptamer and magnetic separation. SENSORS AND ACTUATORS B-CHEMICAL, [PMID:] [10.1016/j.snb.2022.132045]
6. Bi Wang, Pirui Li, Shu Xu, Lanying Liu, Yannan Xu, Xu Feng, Xingzeng Zhao, Yu Chen. (2021) Inhibitory Effects of the Natural Product Esculetin on Phytophthora capsici and Its Possible Mechanism. PLANT DISEASE, 105 (6): [PMID:33332162] [10.1094/PDIS-09-20-2054-RE]
7. Zhao Yunwei, Zhang Hui, Wang Ying, Zhao Yanfang, Li Yaowei, Han Lei, Lu Lihua. (2021) A low-background fluorescent aptasensor for acetamiprid detection based on DNA three-way junction-formed G-quadruplexes and graphene oxide. ANALYTICAL AND BIOANALYTICAL CHEMISTRY, 413 (8): (2071-2079). [PMID:33608750] [10.1007/s00216-020-03141-2]
8. Jing Zhao, Zhaorui Meng, Zexin Zhao, Longshan Zhao. (2019) Ultrasound-assisted deep eutectic solvent as green and efficient media combined with functionalized magnetic multi-walled carbon nanotubes as solid-phase extraction to determine pesticide residues in food products. FOOD CHEMISTRY, [PMID:31835214] [10.1016/j.foodchem.2019.125863]
9. Bi Wang, Fei Liu, Qi Li, Shu Xu, Xingzeng Zhao, Peilin Xue, Xu Feng. (2019) Antifungal activity of zedoary turmeric oil against Phytophthora capsici through damaging cell membrane. PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY, [PMID:31400785] [10.1016/j.pestbp.2019.05.014]
10. Bi Wang, Shu Xu, Yan Cao, Fei Liu, Xingzeng Zhao, Xu Feng. (2018) Fungicidal activity of 10-deacetylbacatin III against Phytophthora capsici via inhibiting lysine biosynthesis. PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY, [PMID:30497701] [10.1016/j.pestbp.2018.09.008]
11. Xiaotong Li, Xiaomin Tang, Xiaojie Chen, Baohan Qu, Lihua Lu. (2018) Label-free and enzyme-free fluorescent isocarbophos aptasensor based on MWCNTs and G-quadruplex. TALANTA, [PMID:30029369] [10.1016/j.talanta.2018.05.092]
12. Xingkun Tang, Yunlong Meng, Haining Li, Kangyu Liu, Xinyao Wang, Zilin Zhong, Junsong Ye, Jianjun Chen. (2024) Characterization of Metalaxyl-induced notochord toxicity based on biochemical and transcriptomics in zebrafish (Danio rerio) model. JOURNAL OF HAZARDOUS MATERIALS, [PMID:39764961] [10.1016/j.jhazmat.2024.136985]
13. Xuexue Xiang, Jing Gao, Fujun Wang, Lu Wang. (2024) Double emulsion templates for efficient production of phase change microcapsules. CHEMICAL ENGINEERING JOURNAL, [PMID:] [10.1016/j.cej.2024.154006]
14. Jingjing Yang, Hai Zhu, Wenhao Liang, Xingzeng Zhao, Min Yin, Xu Feng, Bi Wang. (2024) Fungicidal activity of curcumol against Phytophthora capsici via inhibiting phosphatidylcholine biosynthesis and its systemic translocation in plants. PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY, [PMID:39672648] [10.1016/j.pestbp.2024.106214]
15. Yuee Tian, Wanying Yin, Ruiguang Wang, Huilu Sun, Shaobin Xu, Xiaobo Huang, Genqiang Chen, Zhiping Che. (2024) Non-food renewable and bioactive products for pesticides: Synthesis, anti-oomycete and anti-fungal activities of 9R-acyloxyquinine derivatives bearing an 1,3,4-oxadiazole moiety. INDUSTRIAL CROPS AND PRODUCTS, [PMID:] [10.1016/j.indcrop.2024.119751]
16. Xinyu Luo, Ziyi Liu, Linfan Wang, Liwei Gao, Dingfeng Wang, Ting Zhang, Da Chen. (2024) Smartphone-assisted sensing platform based on dual-responsive nitrogen-doped carbon dots for enzyme-free and visual quantitative detection of Cu2+ and glyphosate. MICROCHEMICAL JOURNAL, [PMID:] [10.1016/j.microc.2024.112166]
17. Mei Hu, Xiaolong Guo, Yuee Tian, Yan Li, Yibo Liu, Xiaobo Huang, Genqiang Chen, Zhiping Che. (2024) Synthesis of paeonol hydrazone derivatives and their anti-oomycete, anti-fungal, and nematicidal activities. PEST MANAGEMENT SCIENCE, [PMID:39003636] [10.1002/ps.8306]
18. Zhiping Che, Ruiguang Wang, Yuanhao Li, Wanying Yin, Huilu Sun, Shaobin Xu, Shaoyan Shuang, Yuee Tian, Xiaobo Huang, Genqiang Chen. (2024) Synthesis, Anti-Oomycete and Anti-Fungal Activities of Anhydride Derivatives of Oleanolic Acid. CHEMISTRY & BIODIVERSITY, [PMID:39198232] [10.1002/cbdv.202401952]
19. Xiaofang Zhang, Xiaolong Guo, Wanying Yin, Ruiguang Wang, Yuee Tian, Huilu Sun, Shaobin Xu, Shaoyan Shuang, Xiaobo Huang, Genqiang Chen, Zhiping Che. (2024) Synthesis, anti-oomycete and anti-fungal activities of novel paeonol ester derivatives containing a schiff base. NATURAL PRODUCT RESEARCH, [PMID:39727242] [10.1080/14786419.2024.2426205]
20. Wenhao Liang, Xiaoxiao Xu, Tong Shi, Shengyang Xu, Qizhi Wang, Bi Wang. (2025) Antimicrobial activity and mechanism of the plant-derived compound evodiamine against Phytophthora capsici. PEST MANAGEMENT SCIENCE, [PMID:40984686] [10.1002/ps.70255]
21. Yibo Liu, Yuee Tian, Hong Peng, Fulong Zhang, Xiaobo Huang, Genqiang Chen, Lin Zhou, Zhiping Che. (2025) Design, Synthesis, and Anti-Oomycete and Antifungal Activities of Novel Paeonol Derivatives Containing a Pyrazole Ring. JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, [PMID:40211589] [10.1021/acs.jafc.4c11375]
22. Zixing Wang, Yuxin Fan, Hong Chen, Xiang Chen, Dexuan Cai, Xihao Tang, Shengrun Zheng, Jun Fan, Songliang Cai, Weiguang Zhang. (2025) Preparation and resolution performances of chiral stationary phases based on spherical covalent organic frameworks with various zeta potentials. JOURNAL OF CHROMATOGRAPHY A, [PMID:40435717] [10.1016/j.chroma.2025.466087]
23. Huilu Sun, Ruxue Wei, Genqiang Chen, Zhiping Che, Xiaobo Huang, Yingwu Chen, Yuee Tian. (2025) Synthesis, Anti-oomycete and Anti-fungal Activities of Novel Eugenol/Dihydroeugenol Derivatives Bearing Carbamate Moiety. CHEMISTRY & BIODIVERSITY, [PMID:40446130] [10.1002/cbdv.202501104]
24. Shaobin Xu, Jiaxuan He, Genqiang Chen, Xiaobo Huang, Yuee Tian, Zhiping Che. (2025) Design, Synthesis, Anti-Oomycete, and Insecticidal Activities of 3β-Acyloxy-18β-Glycyrrhetinic Acid Derivatives. CHEMISTRY & BIODIVERSITY, [PMID:41135017] [10.1002/cbdv.202502978]