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Atraton Standard - 1000ug/ml in Purge and Trap Methanol, high purity , CAS No.1610-17-9
Basic Description
Synonyms
Atraton | 1610-17-9 | Gesatamin | Atroton | ATRATONE | Atraton [ISO] | Geigy 32,293 | 2-Methoxy-4-ethylamino-6-isopropylamino-s-triazine | 2-Methoxy-4-isopropylamino-6-ethylamino-S-triazine | N2-Ethyl-N4-isopropyl-6-methoxy-1,3,5-triazine-2,4-diamine | 2-Ethylamino-4-isoprop
Specifications & Purity
1000ug/ml in Purge and Trap Methanol
Storage Temp
Room temperature
Shipped In
Normal
Product Description
Pesticides Single Component Standards
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Triazines
Subclass
Aminotriazines
Intermediate Tree Nodes
Not available
Direct Parent
1,3,5-triazine-2,4-diamines
Alternative Parents
2-methoxy-1,3,5-triazines Secondary alkylarylamines N-aliphatic s-triazines Alkyl aryl ethers Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2,4-diamine-s-triazine - 2-methoxy-1,3,5-triazine - Alkoxy-s-triazine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - N-aliphatic s-triazine - 1,3,5-triazine - Heteroaromatic compound - Ether - Secondary amine - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3,5-triazine-2,4-diamines. These are aromatic compounds containing a 1,3,5-triazine ring which is 2,4-disusbtituted wit amine groups.
External Descriptors
Triazine herbicides
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.
Names and Identifiers
IUPAC Name
4-N-ethyl-6-methoxy-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
INCHI
InChI=1S/C9H17N5O/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)
InChIKey
PXWUKZGIHQRDHL-UHFFFAOYSA-N
Smiles
CCNC1=NC(=NC(=N1)OC)NC(C)C
Isomeric SMILES
CCNC1=NC(=NC(=N1)OC)NC(C)C
Molecular Weight
211.26
Reaxy-Rn
613098
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=613098&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Melt Point(°C)
94～96℃
Molecular Weight
211.260 g/mol
XLogP3
2.700
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
5
Exact Mass
211.143 Da
Monoisotopic Mass
211.143 Da
Topological Polar Surface Area
72.000 Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
178.000
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
1.
Yuze Xie, Mingwei Wang, Xi Chen, Shufen Wang, Dandan Han, Yehong Han, Hongyuan Yan.
(2019)
3-Aminophenol-glyoxylic acid resin for the determination of triazine herbicides in tomatoes. ANALYTICA CHIMICA ACTA,
1061
(122).
2.
Li Liang, Xinghua Wang, Ying Sun, Pinyi Ma, Xinpei Li, Huilan Piao, Yanxiao Jiang, Daqian Song.
(2018)
Magnetic solid-phase extraction of triazine herbicides from rice using metal-organic framework MIL-101(Cr) functionalized magnetic particles. TALANTA,
179
(512).
3.
Li Xinpei, Wang Yuanpeng, Sun Qun, Xu Bo, Yang Zhaoqing, Wang Xinghua.
(2016)
Molecularly Imprinted Dispersive Solid-Phase Extraction for the Determination of Triazine Herbicides in Grape Seeds by High-Performance Liquid Chromatography. JOURNAL OF CHROMATOGRAPHIC SCIENCE,
54
(5):
(871-877).
4.
Yang Xu, Jingyi Bao, Yuhan Ning, Weiping Wang, Ai-jun Wang, Jiu-ju Feng.
(2024)
Porous poly(bismaleimide-co-divinylbenzene) microspheres as dispersive solid-phase extraction adsorbent coupled to high-performance liquid chromatography for the determination of triazine herbicide residues in vegetable samples. JOURNAL OF SEPARATION SCIENCE,
47
(5):
(2300746).
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4 Citations
J2213060