N,N-Dipropilanilina - ≥98%(GC) , CAS No.2217-07-4

CAS: 2217-07-4 Cat. No.: N159178 Peso molecular: 177.29 Beilstein Registry Number: 12(3)268 Número EC: 218-705-9

GRADE & PURITY ≥98%(GC)

Synonyms

N,N-Di-(n-propil)bencenamina | BZ9F2K19KE | Dipropilamina, N-fenil- | Bencenamina,N,N-dipropil- | N,N-Di-n-propililina | Anilina,N-dipropil- | D89952 | CAA21707 | N,N-DIPROPYLBENZENAMINA | Bencenamina,N-dipropil- | Bencenamina, N,N-dipropil- | Anilina,

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

N, N-Di-(n-propil)bencenamina | BZ9F2K19KE | Dipropilamina, N-fenil- | Bencenamina, N, N-dipropil- | N, N-Di-n-propililina | Anilina, N-dipropil- | D89952 | CAA21707 | N, N-DIPROPYLBENZENAMINA | Bencenamina, N-dipropil- | Bencenamina, N, N-dipropil- | Anilina,

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%(GC)

Nombres e identificadores

• Pubchem Sid: 488185052
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488185052
• Sonrisas canónicas: CCCN(CCC)C1=CC=CC=C1
• IUPAC Name: N,N-dipropylaniline
• InChIKey: MMFBQHXDINNBMW-UHFFFAOYSA-N
• INCHI: 1S/C12H19N/c1-3-10-13(11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
• Isómeros SMILES: CCCN(CCC)C1=CC=CC=C1
• Peso molecular: 177.29
• Beilstein: 12(3)268
• Reaxy-Rn: 638303
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=638303&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines
        • Level5 Tertiary amines
          • Level6 Tertiary alkylarylamines
            • Level7 Dialkylarylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines - Tertiary alkylarylamines
• Direct Parent: Dialkylarylamines
• Alternative Parents: Aniline and substituted anilines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Dialkylarylamine - Benzenoid - Monocyclic benzene moiety - Organopnictogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dialkylarylamines. These are aliphatic aromatic amines in which the amino group is linked to two aliphatic chains and one aromatic group.
• 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

• Sensibilidad: air sensitive
• Índice de refracción: 1.52
• Punto de ebullición (°C): 112°C/11.3mmHg
• Peso molecular: 177.290 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 177.152 Da
• Monoisotopic Mass: 177.152 Da
• Topological Polar Surface Area: 3.200 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 110.000
• 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