11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl-

Base Information

• Chemical Name: 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl-
• CAS No.: 127040-51-1
• Molecular Formula: C₁₉H₁₈ClN₃
• Molecular Weight: 323.825
• DSSTox Substance ID: DTXSID20155384
• Wikidata: Q83023288
• Mol file: 127040-51-1.mol

Synonyms:BRN 4266455;11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl-;3-Chloro-11-(beta-dimethylaminoethyl)pyrido(3,2-a)carbazole;3-Chloro-N,N-dimethyl-11H-pyrido(3,2-a)carbazole-11-ethanamine;127040-51-1;DTXSID20155384;LS-133292

Chemical Property of 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl-

Chemical Property:

• Vapor Pressure: 2.42E-10mmHg at 25°C
• Boiling Point: 505.5°C at 760 mmHg
• Flash Point: 259.5°C
• Density: 1.25g/cm³
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 323.1189253
• Heavy Atom Count: 23
• Complexity: 415

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCN1C2=CC=CC=C2C3=C1C4=C(C=C3)N=C(C=C4)Cl

Technology Process of 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl-

There total 3 articles about 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl- 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: 71.0%

11H-3-chloropyrido<3,2-a>carbazole (127040-42-0) + 2-(dimethylamino)ethyl chloride (107-99-3) → 3-chloro-11-(γ-dimethylaminoethyl)pyrido<3,2-a>carbazole (127040-51-1)

Guidance literature:

With potassium hydroxide; In dimethyl sulfoxide; for 6h;

DOI:10.1007/BF00764806

Reference yield:

11H-3-oxo-3,4-dihydropyrido<3,2-a>carbazole (127040-41-9) → 3-chloro-11-(γ-dimethylaminoethyl)pyrido<3,2-a>carbazole (127040-51-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 96 percent / POCl₃, Et₃N*HCl / 1 h / Heating

2: 71 percent / KOH / dimethylsulfoxide / 6 h

With potassium hydroxide; triethylamine hydrochloride; trichlorophosphate; In dimethyl sulfoxide;

DOI:10.1007/BF00764806

Reference yield:

11H-3-oxo-3,4,5,6-tetrahydropyrido<3,2-a>carbazole (127040-37-3) → 3-chloro-11-(γ-dimethylaminoethyl)pyrido<3,2-a>carbazole (127040-51-1)

Guidance literature:

Multi-step reaction with 3 steps

1: 94 percent / chloranil / benzene / 2 h / Heating

2: 96 percent / POCl₃, Et₃N*HCl / 1 h / Heating

3: 71 percent / KOH / dimethylsulfoxide / 6 h

With potassium hydroxide; triethylamine hydrochloride; chloranil; trichlorophosphate; In dimethyl sulfoxide; benzene;

DOI:10.1007/BF00764806

upstream raw materials:

11H-3-chloropyrido<3,2-a>carbazole

2-(dimethylamino)ethyl chloride

11H-3-oxo-3,4-dihydropyrido<3,2-a>carbazole

11H-3-oxo-3,4,5,6-tetrahydropyrido<3,2-a>carbazole