Prometryn solution - analytical standard, 10μg/ml in acetone , CAS No.7287-19-6

CAS: 7287-19-6 Cat. No.: P109356 Formula: C₁₀H₁₉N₅S Peso molecolare: 241.36 Beilstein Registry Number: 613575 Numero EC: 230-711-3

QUALITÀ & PUREZZA Analytical standard, 10μg/ml in acetone

Synonyms

prometryn|7287-19-6|Prometryne|Gesagard|Caparol|Mercazin|Prometrex|Selectin|Uvon|Primatol Q|Promethryn|Mercasin|Merkazin|Polisin|Prometrin|Selektin|Sesagard|Gesagard 50|Gesagarde 50 Wp|Selectin 50|Caparol 80W|Promepin|1,3,5-Triazine-2,4-diamine, N,N'-bis(

Storage

Room temperature

Shipped In

Normal

Specifiche

Sinonimi

prometryn | 7287-19-6 | Prometryne | Gesagard | Caparol | Mercazin | Prometrex | Selectin | Uvon | Primatol Q | Promethryn | Mercasin | Merkazin | Polisin | Prometrin | Selektin | Sesagard | Gesagard 50 | Gesagarde 50 Wp | Selectin 50 | Caparol 80W | Promepin | 1,3,5-Triazine-2,4-diamine, N,N'-bis(

Specifiche e purezza

analytical standard, 10μg/ml in acetone

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Grado

Standard analitico

Nomi e identificatori

Pubchem Sid

528771900

Sorrisi canonici

CC(C)NC1=NC(=NC(=N1)SC)NC(C)C

IUPAC Name

6-methylsulfanyl-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine

InChIKey

AAEVYOVXGOFMJO-UHFFFAOYSA-N

INCHI

1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)

Isomeri SMILES

CC(C)NC1=NC(=NC(=N1)SC)NC(C)C

WGK Germania

2

RTECS

XY4390000

Numero UN

3077

Gruppo di imballaggio

III

Peso molecolare

241.36

Beilstein

613575

Reaxy-Rn

613575

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=613575&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: 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
• Descrizione: 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

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Punto di fusione (°C): 118-120°C
• Peso molecolare: 241.360 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 241.136 Da
• Monoisotopic Mass: 241.136 Da
• Topological Polar Surface Area: 88.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 182.000
• 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