2-(3-Thienyl)ethylamin - ≥95% , CAS No.59311-67-0

CAS: 59311-67-0 Cat. No.: T337701 Summenformel: C₆H₉NS Molekulargewicht: 127.21 EG-Nummer: 977-434-0 PubChem CID: 12258737

GRADE & PURITY ≥95%

Synonyms

F2189-0507 | FT-0640595 | BS-12834 | DTXSID50482771 | MFCD00176329 | BDBM50581616 | EN300-33653 | 2-(THIOPHEN-3-YL)ETHAN-1-AMIN | [2-(3-Thienyl)ethyl]amin | BB 0257696 | A832261 | J-506633 | SY034366 | AKOS000152261 | 3-(2-aminoethyl)thiophen | 2-(THIO

Storage

Lagerung bei 2-8°C, vor Licht geschützt, mit Argon gefüllt

Shipped In

Nasses Eis

Specifications

Synonyme

F2189-0507 | FT-0640595 | BS-12834 | DTXSID50482771 | MFCD00176329 | BDBM50581616 | EN300-33653 | 2-(THIOPHEN-3-YL)ETHAN-1-AMIN | [2-(3-Thienyl)ethyl]amin | BB 0257696 | A832261 | J-506633 | SY034366 | AKOS000152261 | 3-(2-aminoethyl)thiophen | 2-(THIO

Spezifikationen & Reinheit

≥95%

Storage

Lagerung bei 2-8°C, vor Licht geschützt, mit Argon gefüllt

Verschickt in

Nasses Eis

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

504767020

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504767020

Kanonisches Lächeln

C1=CSC=C1CCN

IUPAC Name

2-thiophen-3-ylethanamine

InChIKey

OANLWIQYRRVBPY-UHFFFAOYSA-N

INCHI

1S/C6H9NS/c7-3-1-6-2-4-8-5-6/h2,4-5H,1,3,7H2

Isomere SMILES

C1=CSC=C1CCN

PubChem CID

12258737

Molekulargewicht

127.21

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Amines
        • Ebene5 Primary amines
          • Ebene6 2-arylethylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: 2-arylethylamines
• Alternative Parents: Aralkylamines Thiophenes Heteroaromatic compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-arylethylamine - Aralkylamine - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Hydrocarbon derivative - Primary aliphatic amine - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as 2-arylethylamines. These are primary amines that have the general formula RCCNH2, where R is an organic 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

Zugehörige Ziele (nicht menschlich)

Pseudomonas aeruginosa (123386 Activities)

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Acinetobacter baumannii (41033 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light sensitive
• Molekulargewicht: 127.210 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 127.046 Da
• Monoisotopic Mass: 127.046 Da
• Topological Polar Surface Area: 54.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 65.500
• 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