5-Chlorotryptamine Hydrochloride - ≥98%(N) , CAS No.942-26-7

CAS: 942-26-7 Cat. No.: C154096 Summenformel: C₁₀H₁₁ClN₂·HCl Molekulargewicht: 231.12 Beilstein Registry Number: 22(3/4)4349 EG-Nummer: 213-387-8

GRADE & PURITY ≥98%(N)

Synonyms

2-(5-chloro-1h-indol-3-yl)ethyl amine hcl | 5-Chloro-1H-indole-3-ethylamine HCl | 5-Chloro-3-(2-aminoethyl)indole Hydrochloride | 2-(5-chloro-1H-indol-3-yl) ethanamine hydrochloride | 5-Chlorotryptamine Hydrochloride | DTXSID60971121 | [2-(5-chloro-1H-ind

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

2-(5-chloro-1h-indol-3-yl)ethyl amine hcl | 5-Chloro-1H-indole-3-ethylamine HCl | 5-Chloro-3-(2-aminoethyl)indole Hydrochloride | 2-(5-chloro-1H-indol-3-yl) ethanamine hydrochloride | 5-Chlorotryptamine Hydrochloride | DTXSID60971121 | [2-(5-chloro-1H-ind

Spezifikationen & Reinheit

≥98%(N)

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥98%(N)

Namen und Kennungen

• Pubchem Sid: 488194086
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488194086
• Kanonisches Lächeln: C1=CC2=C(C=C1Cl)C(=CN2)CCN.Cl
• IUPAC Name: 2-(5-chloro-1H-indol-3-yl)ethanamine;hydrochloride
• InChIKey: PBANXRNIXGEHPZ-UHFFFAOYSA-N
• INCHI: 1S/C10H11ClN2.ClH/c11-8-1-2-10-9(5-8)7(3-4-12)6-13-10;/h1-2,5-6,13H,3-4,12H2;1H
• Isomere SMILES: C1=CC2=C(C=C1Cl)C(=CN2)CCN.Cl
• Molekulargewicht: 231.12
• Beilstein: 22(3/4)4349
• Reaxy-Rn: 3718105
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3718105&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Indoles and derivatives
      • Subclass Tryptamines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Indoles and derivatives
• Subclass: Tryptamines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Tryptamines and derivatives
• Alternative Parents: 3-alkylindoles 2-arylethylamines Aralkylamines Substituted pyrroles Benzenoids Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organochlorides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Tryptamine - 3-alkylindole - Indole - 2-arylethylamine - Aralkylamine - Aryl chloride - Aryl halide - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Azacycle - Amine - Hydrochloride - Primary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as tryptamines and derivatives. These are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine.
• 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: Easy to absorb moisture
• Schmelzpunkt (°C): 290° dec.
• Molekulargewicht: 231.120 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 230.038 Da
• Monoisotopic Mass: 230.038 Da
• Topological Polar Surface Area: 41.800 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 174.000
• 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: 2

XLogP3

Häufig gestellte Fragen

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 942-26-7, the molecular formula is C10H11ClN2·HCl, and the molecular weight is 231.12 g/mol. InChIKey PBANXRNIXGEHPZ-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.