N-Allyl-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole-4-methylamine methanesulfonate

Base Information

• Chemical Name: N-Allyl-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole-4-methylamine methanesulfonate
• CAS No.: 73425-69-1
• Molecular Formula: CH₄O₃S*C₁₅H₁₈N₂S
• Molecular Weight: 354.494
• DSSTox Substance ID: DTXSID30994165

Synonyms:N-Allyl-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole-4-methylamine methanesulfonate;4-((Allylamino)methyl)-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole methanesulfonate;Thiopyrano(2,3-b)indole, 2,3,4,9-tetrahydro-4-((allylamino)methyl)-, methanesulfonate;Thiopyrano(2,3-b)indole-4-methanamine, 2,3,4,9-tetrahydro-N-2-propenyl-, methanesulfonate;Thiopyrano(2,3-b)indole-4-methylamine, 2,3,4,9-tetrahydro-N-allyl-, methanesulfonate;73425-69-1;C15H18N2S.CH4O3S;DTXSID30994165;C15-H18-N2-S.C-H4-O3-S;LS-153272;Methanesulfonic acid--1-[9-(prop-2-en-1-yl)-2,3,4,9-tetrahydrothiopyrano[2,3-b]indol-4-yl]methanamine (1/1)

Chemical Property of N-Allyl-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole-4-methylamine methanesulfonate

Chemical Property:

• Vapor Pressure: 2.62E-07mmHg at 25°C
• Boiling Point: 421.4°Cat760mmHg
• Flash Point: 208.6°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 354.10718492
• Heavy Atom Count: 23
• Complexity: 399

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CS(=O)(=O)O.C=CCN1C2=CC=CC=C2C3=C1SCCC3CN

Technology Process of N-Allyl-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole-4-methylamine methanesulfonate

There total 3 articles about N-Allyl-2,3,4,9-tetrahydrothiopyrano(2,3-b)indole-4-methylamine methanesulfonate 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:

4-hydroxybut-2-ynil indol-2-yl sulfide (73425-07-7) → Allyl-(2,3,4,9-tetrahydro-thiopyrano[2,3-b]indol-4-ylmethyl)-amine; compound with methanesulfonic acid (73425-69-1)

Guidance literature:

Multi-step reaction with 2 steps

1: Heating

2: 1) NaBH₄

With sodium tetrahydroborate;

DOI:10.1248/cpb.32.877

Reference yield:

2,3,4,9-tetrahydrothiopyrano<2,3-b>indole-4-carbaldehyde (73425-08-8) + methanesulfonic acid (75-75-2,98527-29-8) + 1-amino-2-propene (107-11-9,30551-89-4) → Allyl-(2,3,4,9-tetrahydro-thiopyrano[2,3-b]indol-4-ylmethyl)-amine; compound with methanesulfonic acid (73425-69-1)

Guidance literature:

With sodium tetrahydroborate; Yield given. Multistep reaction;

DOI:10.1248/cpb.32.877

Reference yield:

→ Allyl-(2,3,4,9-tetrahydro-thiopyrano[2,3-b]indol-4-ylmethyl)-amine; compound with methanesulfonic acid (73425-69-1)

Guidance literature:

upstream raw materials:

2,3,4,9-tetrahydrothiopyrano<2,3-b>indole-4-carbaldehyde

methanesulfonic acid

1-amino-2-propene

4-hydroxybut-2-ynil indol-2-yl sulfide

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