Ametryn - analytical standard, ≥98.8% , CAS No.834-12-8

CAS: 834-12-8 Cat. No.: A114940 Summenformel: C₉H₁₇N₅S Molekulargewicht: 227.33 Beilstein Registry Number: 613099 EG-Nummer: 212-634-7

QUALITÄT & REINHEIT Analytical standard, ≥98.8%

Synonyms

20B - Triazines and Urea Herbicides in Wastewater|Evik 80W (Salt/Mix)|1,3,5-Triazine-2,4-diamine, N-ethyl-N'-(1-methylethyl)-6-(methylthio)-|Amephyt|(Ethylamino)-4-(isopropylamino)-6-(methylthio)-s-triazine|Ametrex|4-N-ethyl-6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine|2-(methylthio)-4-(1-methylethylamino)-6-(ethylamino)-1,3,5-triazine|N-ethyl-6-(methylsulfanyl)-N'-(propan-2-yl)-1,3,5-triazine-2,4-diamine|AMETRYN [HSDB]|AMETRYN [MI]|N4-ethyl-6-(methylthio)-N2-propan-2-yl-1,3,5-triazine-2,4-diamine|N'-ethyl-6-methylsulfanyl-N-propan-2-yl-1,3,5-triazine-2,4-diamine|Topazol|1,5-Triazine-2,4-diamine, N-ethyl-N'-(1-methylethyl)-6-(methylthio)-|2-METHYLTHIO-4-ETHYLAMINO-6-ISOPROPYLAMINO-1,3,5-TRIAZINE|N2-Ethyl-N4-isopropyl-6-(methylthio)-1,3,5-triazine-2,4-diamine|N-Ethyl-N'-(1-methylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamine|N-ethyl-N'-(1-methylethyl)-6-(methylthio)-2,4-diaminetriazine|2-(Ethylamino)-4-(isopropylamino)-6-(methylmercapto)-s-triazine|2-(Methylmercapto)-4-(ethylamino)-6-(isopropylamino)-s-triazine|Ametryn [ANSI:BSI:ISO]|Gardopax|N-ethyl-N'-(1-methylethyl)-6-(methylsulfanyl)-1,3,5-triazine-2,4-diamine|Gesapax|Primatol Z 80|2-Ethylamino-4-isopropylamino-6-methylthio-s-triazine|Trinatox D|2-Methylmercapto-4-isopropylamino-6-ethylamino-S-triazine|2-Methylmercapto-4-ethylamino-6-isopropylamino-S-triazine|G 34162|s-Triazine, 2-(ethylamino)-4-(isopropylamino)-6-(methylthio)-|s-Triazine, 2-ethylamino-4-isopropylamino-6-methylthio-|2-Methylthio-4-ethylamino-6-isopropylamino-S-triazine|N4-ethyl-6-methylsulfanyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine|Evik 80W|2-(Methylmercapto)-4-(isopropylamino)-6-(ethylamino)-s-triazine|2-Ethylamino-4-isopropylamino-6-methylthio-1,3,5-triazine|Doruplant|AMETRYNE|N(2)-ethyl-N(4)-isopropyl-6-(methylthio)-1,3,5-triazine-2,4-diamine|08B - Triazines and Urea Herbicides in Clean Water|2-Ethylamino-4-isopropylamino-6-methylthio-s-trizaine|N-Ethyl-N'-isopropyl-6-(methylsulfanyl)-1,3,5-triazine-2,4-diamine|N-Ethyl-N'-isopropyl-6-methylthio-1,3,5-triazine-2,4-diyldiamine|2-Ethylamino-4-isopropylamino-6-methylmercapto-s-triazine|A 1093; Amephyt; Ametrex;Ametryne|Evik|Mebatryne|N-Ethyl-N'-isopropyl-6-methylthio-1,3,5-triazine-2,4-diamine|N-Ethyl-N-isopropyl-6-methylthio-1,3,5-triazine-2,4-diamine|(2-Ethylamino)-4-(isopropylamino)-6-(methylthio)-s-triazine|Ametryn|2-(Ethylamino)-4-(isopropylamino)-6-(methylthio)triazine|Gestene|N-ethyl-N'-isopropyl-6-(methylthio)-1,3,5-triazine-2,4-diamine|2-(Methylthio)-4-(ethylamino)-6-(isopropylamino)-s-triazine|G-34162|Ametrine|Cemerin

Storage

Room temperature

Shipped In

Normal

Spezifikationen

Synonyme

20B - Triazines and Urea Herbicides in Wastewater | Evik 80W (Salt/Mix) | 1,3,5-Triazine-2,4-diamine, N-ethyl-N'-(1-methylethyl)-6-(methylthio)- | Amephyt | (Ethylamino)-4-(isopropylamino)-6-(methylthio)-s-triazine | Ametrex | 4-N-ethyl-6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine | 2-(methylthio)-4-(1-methylethylamino)-6-( Show more

Spezifikationen & Reinheit

analytical standard, ≥98.8%

Storage

Room temperature

Verschickt in

Normal

Note

Analytischer Standard

Reinheit

≥98.8%

Namen und Kennungen

Pubchem Sid

528775484

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528775484

Kanonisches Lächeln

CCNC1=NC(=NC(=N1)SC)NC(C)C

IUPAC Name

4-N-ethyl-6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

InChIKey

RQVYBGPQFYCBGX-UHFFFAOYSA-N

INCHI

1S/C9H17N5S/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)

Isomere SMILES

CCNC1=NC(=NC(=N1)SC)NC(C)C

WGK Deutschland

3

UN-Nummer

2763

Verpackungsgruppe

I

Molekulargewicht

227.33

Beilstein

613099

Reaxy-Rn

613099

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=613099&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Triazines
      • Subclass 1,3,5-triazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Triazines
• Subclass: 1,3,5-triazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Methylthio-s-triazines
• Alternative Parents: Alkyl-2-thio-S-triazines 1,3,5-triazine-2,4-diamines Secondary alkylarylamines N-aliphatic s-triazines Alkylarylthioethers Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Methylthio-s-triazine - 2,4-diamine-s-triazine - Alkyl-2-thio-s-triazine - Aryl thioether - Amino-1,3,5-triazine - Aminotriazine - Secondary aliphatic/aromatic amine - Alkylarylthioether - N-aliphatic s-triazine - Heteroaromatic compound - Azacycle - Sulfenyl compound - Thioether - Secondary amine - Amine - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as methylthio-s-triazines. These are aromatic compounds containing a 1,3,5-triazine ring that is substituted at the 2-position with a methylthio group.
• External Descriptors: s-triazine

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.

DOI: 10.1186/s13321-016-0174-y

Zugehörige Ziele (nicht menschlich)

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Echinochloa crus-galli (3685 Activities)

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Arabidopsis thaliana (307 Activities)

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Heliothis virescens (272 Activities)

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Plutella xylostella (1838 Activities)

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Brassica napus (1186 Activities)

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Digitaria sanguinalis (1594 Activities)

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Stellaria media (151 Activities)

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Fusarium graminearum (1554 Activities)

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Lolium perenne (157 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 84-85°C
• Molekulargewicht: 227.330 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 227.12 Da
• Monoisotopic Mass: 227.12 Da
• Topological Polar Surface Area: 88.000 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