4-(Ethylamino)phenol - ≥97% , CAS No.659-34-7

CAS: 659-34-7 Cat. No.: E589810 Summenformel: C₈H₁₁NO Molekulargewicht: 137.18

GRADE & PURITY ≥97%

Synonyms

p-ethylaminophenol | F88126 | Phenol, 4-(ethylamino)- | SB75468 | DTXSID00984371 | MFCD09744904 | Ba 2831 | (4-hydroxy-phenyl)-ethylamine | Oxyphenyl-Athylamin | 4-(ethylamino)phenol | SCHEMBL440145 | STL484206 | 4-Ethylaminophenol | EN300-75350

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

p-ethylaminophenol | F88126 | Phenol, 4-(ethylamino)- | SB75468 | DTXSID00984371 | MFCD09744904 | Ba 2831 | (4-hydroxy-phenyl)-ethylamine | Oxyphenyl-Athylamin | 4-(ethylamino)phenol | SCHEMBL440145 | STL484206 | 4-Ethylaminophenol | EN300-75350

Spezifikationen & Reinheit

≥97%

Storage

Store at 2-8°C,Protected from light,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

• Kanonisches Lächeln: CCNC1=CC=C(C=C1)O
• IUPAC Name: 4-(ethylamino)phenol
• InChIKey: UJWHLERCFNIFNJ-UHFFFAOYSA-N
• INCHI: 1S/C8H11NO/c1-2-9-7-3-5-8(10)6-4-7/h3-6,9-10H,2H2,1H3
• Isomere SMILES: CCNC1=CC=C(C=C1)O
• Molekulargewicht: 137.18
• Reaxy-Rn: 2689688
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2689688&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Amines
        • Ebene5 Aralkylamines
          • Ebene6 Phenylalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Aralkylamines
• Direct Parent: Phenylalkylamines
• Alternative Parents: p-Aminophenols Aniline and substituted anilines Secondary alkylarylamines 1-hydroxy-2-unsubstituted benzenoids Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: P-aminophenol - Phenylalkylamine - Aniline or substituted anilines - Aminophenol - 1-hydroxy-2-unsubstituted benzenoid - Secondary aliphatic/aromatic amine - Phenol - Benzenoid - Monocyclic benzene moiety - Secondary amine - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenylalkylamines. These are organic amines where the amine group is secondary and linked on one end to a phenyl group and on the other end, to an alkyl 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

• Molekulargewicht: 137.180 g/mol
• XLogP3: 1.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 137.084 Da
• Monoisotopic Mass: 137.084 Da
• Topological Polar Surface Area: 32.299 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 87.300
• 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