2-Methyltryptamine - ≥98% , CAS No.2731-06-8

CAS: 2731-06-8 Cat. No.: M158559 Summenformel: C₁₁H₁₄N₂ Molekulargewicht: 174.25 Beilstein Registry Number: 22(5)10,157 EG-Nummer: 220-347-3

GRADE & PURITY ≥98%

Synonyms

STK072030 | 2-Methyl-1H-indole-3-ethylamine | EU-0053050 | MLS000122004 | Cambridge id 5112300 | FS-1950 | 2-(2-Methyl-1H-indol-3-yl)-ethylamine | N-(2-chlorophenyl)-2-{[2-(diethylamino)ethyl](ethyl)amino}acetamide | SY027668 | BCP25815 | 2-Methyltryptami

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

STK072030 | 2-Methyl-1H-indole-3-ethylamine | EU-0053050 | MLS000122004 | Cambridge id 5112300 | FS-1950 | 2-(2-Methyl-1H-indol-3-yl)-ethylamine | N-(2-chlorophenyl)-2-{[2-(diethylamino)ethyl](ethyl)amino}acetamide | SY027668 | BCP25815 | 2-Methyltryptami

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

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

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

504755009

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755009

Kanonisches Lächeln

CC1=C(C2=CC=CC=C2N1)CCN

IUPAC Name

2-(2-methyl-1H-indol-3-yl)ethanamine

InChIKey

CPVSLHQIPGTMLH-UHFFFAOYSA-N

INCHI

1S/C11H14N2/c1-8-9(6-7-12)10-4-2-3-5-11(10)13-8/h2-5,13H,6-7,12H2,1H3

Isomere SMILES

CC1=C(C2=CC=CC=C2N1)CCN

Molekulargewicht

174.25

Beilstein

22(5)10,157

Reaxy-Rn

133962

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=133962&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 Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Tryptamine - 3-alkylindole - Indole - 2-arylethylamine - Aralkylamine - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Azacycle - Hydrocarbon derivative - Organopnictogen compound - Amine - Primary amine - Organonitrogen compound - Primary aliphatic amine - 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Air Sensitive,Heat Sensitive
• Siedepunkt (°C): 177°C/1.5mmHg
• Schmelzpunkt (°C): 108 °C
• Molekulargewicht: 174.240 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 174.116 Da
• Monoisotopic Mass: 174.116 Da
• Topological Polar Surface Area: 41.800 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 169.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 2731-06-8, the molecular formula is C11H14N2, and the molecular weight is 174.25 g/mol. InChIKey CPVSLHQIPGTMLH-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.