1,2-Ethanediamine, N,N'-dimethyl-N,N'-bis（2-pyridinylmethyl） - ≥97% , CAS No.136768-57-5

CAS: 136768-57-5 Cat. No.: E299868 Peso molecular: 270.37

GRADE & PURITY ≥97%

Synonyms

DTXSID60452268 | 1,2-Ethanediamine, N1,N2-dimethyl-N1,N2-bis(2-pyridinylmethyl)- | BS-48243 | SCHEMBL996544 | N1,N2-Dimethyl-N1,N2-bis(pyridin-2-ylmethyl)ethane-1,2-diamine | 1,2-Ethanediamine, N,N'-dimethyl-N,N'-bis(2-pyridinylmethyl)- | E77922 | N,N'-di

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Specifications

Sinónimos

DTXSID60452268 | 1, 2-Ethanediamine, N1, N2-dimethyl-N1, N2-bis(2-pyridinylmethyl)- | BS-48243 | SCHEMBL996544 | N1, N2-Dimethyl-N1, N2-bis(pyridin-2-ylmethyl)ethane-1, 2-diamine | 1, 2-Ethanediamine, N, N'-dimethyl-N, N'-bis(2-pyridinylmethyl)- | E77922 | N, N'-di

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: CN(CCN(C)CC1=CC=CC=N1)CC2=CC=CC=N2
• IUPAC Name: N,N'-dimethyl-N,N'-bis(pyridin-2-ylmethyl)ethane-1,2-diamine
• InChIKey: NJAHJMGPPKJUTO-UHFFFAOYSA-N
• INCHI: 1S/C16H22N4/c1-19(13-15-7-3-5-9-17-15)11-12-20(2)14-16-8-4-6-10-18-16/h3-10H,11-14H2,1-2H3
• Isómeros SMILES: CN(CCN(C)CC1=CC=CC=N1)CC2=CC=CC=N2
• Peso molecular: 270.37
• Reaxy-Rn: 414904
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=414904&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyridines and derivatives
      • Subclass 2-pyridylmethylamines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyridines and derivatives
• Subclass: 2-pyridylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: 2-pyridylmethylamines
• Alternative Parents: Aralkylamines Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-pyridylmethylamine - Aralkylamine - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 2-pyridylmethylamines. These are aromatic heterocyclic compounds contaning a pyridine ring which is substituted at the 2-position with a methylamine.
• 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: 270.370 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 270.184 Da
• Monoisotopic Mass: 270.184 Da
• Topological Polar Surface Area: 32.299 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 233.000
• 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