2-Ethyl-1-hexylamine - ≥99% , CAS No.104-75-6

CAS: 104-75-6 Cat. No.: E108992 Formule: C₈H₁₉N Poids moléculaire: 129.24 Beilstein Registry Number: 1209249 Numéro CE: 203-233-8

QUALITÉ & PURETÉ ≥99%

Synonyms

4-04-00-00766 (Beilstein Handbook Reference) | CAS-104-75-6 | EC 203-233-8 | UN 2276 | 2-ethylhexyl amine | beta-Ethylhexylamine | 2-Ethyl hexylamine | E0126 | SCHEMBL28690 | MFCD00008148 | UNII-ER54Q9L9W3 | 2-ethylhexan-1-amine | 3-(aminomethyl)heptane |

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Spécifications

Synonymes

4-04-00-00766 (Beilstein Handbook Reference) | CAS-104-75-6 | EC 203-233-8 | UN 2276 | 2-ethylhexyl amine | beta-Ethylhexylamine | 2-Ethyl hexylamine | E0126 | SCHEMBL28690 | MFCD00008148 | UNII-ER54Q9L9W3 | 2-ethylhexan-1-amine | 3-(aminomethyl)heptane |

Spécifications et pureté

≥99%

Application

2-Ethyl-1-hexylamine can be used as a reactant to synthesize: Carbonyl compounds through oxidative deamination by using N-tert-butylphenylsulfinimidoyl chloride. Nitriles via Ru-catalyzed oxidation in the presence of molecular oxygen. Alkyl isothiocyanate

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

FedEx DG Service

Pureté

≥99%

Noms et identifiants

Pubchem Sid

488180539

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180539

Sourires canoniques

CCCCC(CC)CN

IUPAC Name

2-ethylhexan-1-amine

InChIKey

LTHNHFOGQMKPOV-UHFFFAOYSA-N

INCHI

1S/C8H19N/c1-3-5-6-8(4-2)7-9/h8H,3-7,9H2,1-2H3

Isomères SMILES

CCCCC(CC)CN

WGK Allemagne

2

RTECS

MQ5250000

Numéro ONU

2276

Groupe d'emballage

III

Poids moléculaire

129.24

Beilstein

1209249

Reaxy-Rn

1209249

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1209249&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - Primary aliphatic amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine 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

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Slightly soluble in water, soluble in ethanol and acetone.
• Sensibilité: Air Sensitive
• Indice de réfraction: 1.431
• Point d'éclair (°F): 122 °F
• Point d'éclair (°C): 50℃
• Point d'ébullition (°C): 169°C
• Point de fusion (°C): -76°C
• Poids moléculaire: 129.240 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 129.152 Da
• Monoisotopic Mass: 129.152 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 52.500
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1