2,4-Diamino-6-butylamino-1,3,5-triazine - ≥97%(T) , CAS No.5606-24-6

CAS: 5606-24-6 Cat. No.: D155496 Peso molecular: 182.23 Número EC: 227-025-1

GRADE & PURITY ≥97%(T)

Synonyms

AI3-60006 | EINECS 227-025-1 | Melamine, butyl- | 2-Butylamino-4,6-diamino-1,3,5-triazine | N2-butyl-1,3,5-triazine-2,4,6-triamine | 2,6-Diamino-4-butylamino-s-triazine | DTXSID90204611 | N2-Butylmelamine | 2-N-butyl-1,3,5-triazine-2,4,6-triamine | butylm

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

AI3-60006 | EINECS 227-025-1 | Melamine, butyl- | 2-Butylamino-4, 6-diamino-1, 3, 5-triazine | N2-butyl-1, 3, 5-triazine-2, 4, 6-triamine | 2, 6-Diamino-4-butylamino-s-triazine | DTXSID90204611 | N2-Butylmelamine | 2-N-butyl-1, 3, 5-triazine-2, 4, 6-triamine | butylm

Especificaciones y pureza

≥97%(T)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%(T)

Nombres e identificadores

• Pubchem Sid: 504757795
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757795
• Sonrisas canónicas: CCCCNC1=NC(=NC(=N1)N)N
• IUPAC Name: 2-N-butyl-1,3,5-triazine-2,4,6-triamine
• InChIKey: CVKGSDYWCFQOKU-UHFFFAOYSA-N
• INCHI: 1S/C7H14N6/c1-2-3-4-10-7-12-5(8)11-6(9)13-7/h2-4H2,1H3,(H5,8,9,10,11,12,13)
• Isómeros SMILES: CCCCNC1=NC(=NC(=N1)N)N
• RTECS: XY5852000
• Peso molecular: 182.23
• Reaxy-Rn: 10741
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10741&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Triazines
      • Subclass Aminotriazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Triazines
• Subclass: Aminotriazines
• Intermediate Tree Nodes: Not available
• Direct Parent: N-aliphatic s-triazines
• Alternative Parents: Secondary alkylarylamines 1,3,5-triazines Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-aliphatic s-triazine - Secondary aliphatic/aromatic amine - 1,3,5-triazine - Heteroaromatic compound - Azacycle - Secondary amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as n-aliphatic s-triazines. These are n-aliphatic amine derivatives of 1,3,5-triazines. 1,3,5-triazines are aromatic compounds having three nitrogen ring atoms at the 1-, 3-, and 5- positions.
• External Descriptors: Not available

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

Propiedades químicas y físicas

• Peso molecular: 182.230 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 182.128 Da
• Monoisotopic Mass: 182.128 Da
• Topological Polar Surface Area: 103.000 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 131.000
• 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