2-(4-Aminophenyl)ethylamine - ≥97% , CAS No.13472-00-9

CAS: 13472-00-9 Cat. No.: A151503 Fórmula: C₈H₁₂N₂ Peso molecular: 136.2 Beilstein Registry Number: 1099910 Número EC: 236-739-2

GRADE & PURITY ≥97%

Synonyms

4-Amino-.beta.-phenylethylamine | 4-AMINOPHENYL ETHYLAMINE | 1-Amino-2-(4-aminophenyl)ethane | AMY31595 | 4-aminoethylaniline | 4-(2-Aminoethyl)aniline | 4-(2-Amino-ethyl)-aniline | 4-(2-Aminoethyl)aniline, 97% | FT-0650483 | 2-(4-Aminophenyl)ethylamine |

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Descripción general

4-(2-Aminoethyl)aniline undergoes coupling with carbohydrates by reductive amination to yield modified carbohydrates.

4-(2-Aminoethyl)aniline has been used in chemical modification of silk fibroin to tailor the overall hydrophilicity and structure of silk. It has been used as reagent in polycondensation reactions.

Specifications

Sinónimos

4-Amino-.beta.-phenylethylamine | 4-AMINOPHENYL ETHYLAMINE | 1-Amino-2-(4-aminophenyl)ethane | AMY31595 | 4-aminoethylaniline | 4-(2-Aminoethyl)aniline | 4-(2-Amino-ethyl)-aniline | 4-(2-Aminoethyl)aniline, 97% | FT-0650483 | 2-(4-Aminophenyl)ethylamine |

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Protected from light,Room temperature,Argon charged

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

Pubchem Sid

504754678

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754678

Sonrisas canónicas

C1=CC(=CC=C1CCN)N

IUPAC Name

4-(2-aminoethyl)aniline

InChIKey

LNPMZQXEPNWCMG-UHFFFAOYSA-N

INCHI

1S/C8H12N2/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5-6,9-10H2

Isómeros SMILES

C1=CC(=CC=C1CCN)N

WGK Alemania

3

Peso molecular

136.2

Beilstein

1099910

Reaxy-Rn

1099913

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1099913&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenethylamines
• Alternative Parents: Aniline and substituted anilines 2-arylethylamines Aralkylamines Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenethylamine - 2-arylethylamine - Aniline or substituted anilines - Aralkylamine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Insoluble in water.
• Sensibilidad: Air sensitive ；Light sensitive
• Índice de refracción: 1.59
• Punto de inflamación (°F): 235.4 °F
• Punto de inflamación (°C): 113 °C
• Punto de ebullición (°C): 142 °C
• Punto de fusión (°C): 28 °C
• Peso molecular: 136.190 g/mol
• XLogP3: -0.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 136.1 Da
• Monoisotopic Mass: 136.1 Da
• Topological Polar Surface Area: 52.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 85.300
• 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