5-Aminotryptamine

Base Information

• Chemical Name: 5-Aminotryptamine
• CAS No.: 1078-00-8
• Molecular Formula: C10H13N3
• Molecular Weight: 175.23
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID90148243
• Nikkaji Number: J2.680.208C
• Wikidata: Q27216278
• ChEMBL ID: CHEMBL26305
• Mol file: 1078-00-8.mol

Synonyms:5-Aminotryptamine;1078-00-8;3-(2-aminoethyl)-1H-indol-5-amine;1H-Indole-3-ethanamine, 5-amino-;1H-Indole-3-ethanamine,5-amino-;CHEMBL26305;C10H13N3;SCHEMBL2847185;DTXSID90148243;5-Amino-1H-indole-3-ethaneamine;CHEBI:125668;BDBM50470848;PDSP1_000823;PDSP2_000810;AKOS006280266;FT-0692680;A-7220;EN300-116209;BRD-K91844626-001-01-8;Q27216278

Chemical Property of 5-Aminotryptamine

Chemical Property:

• Vapor Pressure: 1.88E-07mmHg at 25°C
• Refractive Index: 1.725
• Boiling Point: 425.7 °C at 760 mmHg
• PKA: 17.60±0.30(Predicted)
• Flash Point: 240.9 °C
• PSA: 67.83000
• Density: 1.245 g/cm³
• LogP: 2.53280
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 175.110947427
• Heavy Atom Count: 13
• Complexity: 172

Purity/Quality:

98%,99%, ^*data from raw suppliers

5-AMINOTRYPTAMINE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1N)C(=CN2)CCN

Technology Process of 5-Aminotryptamine

There total 6 articles about 5-Aminotryptamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 70.0%

2-(5-nitro-1H-indol-3-yl)-2-oxoacetamide (393835-64-8) → 5-Aminotryptamine (1078-00-8)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; 1,4-dioxane; at 0 ℃; for 48h; Inert atmosphere; Reflux;

DOI:10.1016/j.tetlet.2008.10.091

Reference yield: 63.0%

(E)-5-nitro-3-(2-nitrovinyl)-1H-indole (1108197-60-9) → 5-Aminotryptamine (1078-00-8)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; 1,4-dioxane; at 0 ℃; Inert atmosphere; Reflux;

DOI:10.1016/j.tetlet.2008.10.091

Reference yield:

2-(5-nitro-1H-indol-3-yl) ethan-1-amine (55747-72-3) → 5-Aminotryptamine (1078-00-8)

Guidance literature:

With sodium hydroxide; sodium dithionite;

DOI:10.1021/ja01104a029

upstream raw materials:

2-(5-nitro-1H-indol-3-yl) ethan-1-amine

3-(2-chloro-ethyl)-5-nitro-indole

(E)-5-nitro-3-(2-nitrovinyl)-1H-indole

2-(5-nitro-1H-indol-3-yl)-2-oxoacetamide

Refernces

• 1、 -. "IDO inhibitors". Page/Page column 309; 310. . Retrieved 2018/09/02.
• 2、 Friedrich, Anne,Br?se, Stefan,O'Connor, Sarah E.. "Synthesis of 4-, 5-, 6-, and 7-azidotryptamines". supporting information; body text. p. 75 - 76. Retrieved 2009/04/14.