N-(3-Hydroxypropyl)ethylenediamine - ≥97%(GC) , CAS No.56344-32-2

CAS: 56344-32-2 Cat. No.: N159094 Peso molecular: 118.18 Número EC: 679-901-1

GRADE & PURITY ≥97%(GC)

Synonyms

N-(2-Aminoethyl)propanolamine | N-(3-Hydroxypropyl)ethylenediamine | 3-((2-Aminoethyl)amino)propan-1-ol | N-hydroxypropylethylenediamine | H0391 | N-(3-hydroxypropyl)ethylendiamine | 3-[(2-aminoethyl)amino]propan-1-ol | A869967 | AKOS009157810 | 3-(2-amin

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

N-(2-Aminoethyl)propanolamine | N-(3-Hydroxypropyl)ethylenediamine | 3-((2-Aminoethyl)amino)propan-1-ol | N-hydroxypropylethylenediamine | H0391 | N-(3-hydroxypropyl)ethylendiamine | 3-[(2-aminoethyl)amino]propan-1-ol | A869967 | AKOS009157810 | 3-(2-amin

Especificaciones y pureza

≥97%(GC)

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥97%(GC)

Nombres e identificadores

• Pubchem Sid: 504765814
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504765814
• Sonrisas canónicas: C(CNCCN)CO
• IUPAC Name: 3-(2-aminoethylamino)propan-1-ol
• InChIKey: KTLIZDDPOZZHCD-UHFFFAOYSA-N
• INCHI: 1S/C5H14N2O/c6-2-4-7-3-1-5-8/h7-8H,1-6H2
• Isómeros SMILES: C(CNCCN)CO
• Peso molecular: 118.18
• Reaxy-Rn: 1734408
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1734408&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines
        • Level5 Alkanolamines
          • Level6 1,3-aminoalcohols

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Alkanolamines
• Direct Parent: 1,3-aminoalcohols
• Alternative Parents: Dialkylamines Primary alcohols Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: 1,3-aminoalcohol - Secondary amine - Secondary aliphatic amine - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Primary alcohol - Organooxygen compound - Primary aliphatic amine - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 1,3-aminoalcohols. These are organic compounds containing an alkyl chain with an amine group bound to the C1 atom and an alcohol group bound to the C3 atom.
• 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

• Solubilidad: Soluble in water
• Sensibilidad: Hygroscopic
• Punto de ebullición (°C): 149 °C/14 mmHg
• Punto de fusión (°C): 49 °C
• Peso molecular: 118.180 g/mol
• XLogP3: -1.500
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 118.111 Da
• Monoisotopic Mass: 118.111 Da
• Topological Polar Surface Area: 58.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 41.400
• 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