N-Ethylcyclohexylamine - ≥99%(GC) , CAS No.5459-93-8

CAS: 5459-93-8 Cat. No.: E124549 Summenformel: C₈H₁₇N Molekulargewicht: 127.23 Beilstein Registry Number: 2070280 EG-Nummer: 226-733-8

GRADE & PURITY ≥99%(GC)

Synonyms

N-Cyclohexyl-N-ethylamine | InChI=1/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H | E0506 | NCGC00341960-01 | N-Ethylcyclohexanamine | E79211 | Cyclohexanamine, N-ethyl- | Cyclohexane, (ethylamino)- | N-Ethyl(cyclohexyl)amine | Vulkacit HX | EC 226-733-8 | S

Storage

Room temperature,Argon charged

Shipped In

Normal

Übersicht

N-Ethylcyclohexylamine was used in the synthesis of a series of isatin-N-Mannich bases

Specifications

Synonyme

N-Cyclohexyl-N-ethylamine | InChI=1/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H | E0506 | NCGC00341960-01 | N-Ethylcyclohexanamine | E79211 | Cyclohexanamine, N-ethyl- | Cyclohexane, (ethylamino)- | N-Ethyl(cyclohexyl)amine | Vulkacit HX | EC 226-733-8 | S

Spezifikationen & Reinheit

≥99%(GC)

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥99%(GC)

Namen und Kennungen

• Pubchem Sid: 508810895
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508810895
• Kanonisches Lächeln: CCNC1CCCCC1
• IUPAC Name: N-ethylcyclohexanamine
• InChIKey: AGVKXDPPPSLISR-UHFFFAOYSA-N
• INCHI: 1S/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H3
• Isomere SMILES: CCNC1CCCCC1
• WGK Deutschland: 3
• RTECS: GX1225000
• UN-Nummer: 1993
• Verpackungsgruppe: I
• Molekulargewicht: 127.23
• Beilstein: 2070280
• Reaxy-Rn: 2070280
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2070280&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Cyclohexylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Cyclohexylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclohexylamines
• Alternative Parents: Dialkylamines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexylamine - Secondary amine - Secondary aliphatic amine - Organopnictogen compound - Hydrocarbon derivative - Amine - Aliphatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as cyclohexylamines. These are organic compounds containing a cyclohexylamine moiety, which consist of a cyclohexane ring attached to an 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Air sensitive
• Brechungsindex: 1.4500 - 1.4530
• Flammpunkt (°C): 30°C
• Siedepunkt (°C): 164°C
• Molekulargewicht: 127.230 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 127.136 Da
• Monoisotopic Mass: 127.136 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 65.000
• 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