(S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-8-methoxy-2,3-dihydro-1,4-benzodioxin-2beta-methanamine

Base Information

Chemical Name:(S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-8-methoxy-2,3-dihydro-1,4-benzodioxin-2beta-methanamine
CAS No.:766498-48-0
Molecular Formula:C₂₀H₂₅NO₆
Molecular Weight:375.422
Hs Code.:
DSSTox Substance ID:DTXSID501122385
Nikkaji Number:J1.511.637D
ChEMBL ID:CHEMBL2221147

Synonyms:CHEMBL2153553;CHEMBL2221147;DTXSID501122385;BDBM50392641;(2S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-2,3-dihydro-8-methoxy-1,4-benzodioxin-2-methanamine;(S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-8-methoxy-2,3-dihydro-1,4-benzodioxin-2beta-methanamine;766498-48-0

Suppliers and Price of (S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-8-methoxy-2,3-dihydro-1,4-benzodioxin-2beta-methanamine

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of (S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-8-methoxy-2,3-dihydro-1,4-benzodioxin-2beta-methanamine

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:375.16818752
Heavy Atom Count:27
Complexity:413

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=C(C(=CC=C1)OC)OCCNCC2COC3=C(O2)C(=CC=C3)OC
Isomeric SMILES:COC1=C(C(=CC=C1)OC)OCCNC[C@H]2COC3=C(O2)C(=CC=C3)OC

Technology Process of (S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-8-methoxy-2,3-dihydro-1,4-benzodioxin-2beta-methanamine

There total 8 articles about (S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-8-methoxy-2,3-dihydro-1,4-benzodioxin-2beta-methanamine 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:

: 5150-42-5
2,3-dimethoxyphenol

: 766498-48-0
(2S)-2-[((2-(2,6-dimethoxyphenoxy)ethyl)amino)methyl]-8-methoxy-1,4-benzodioxane

Guidance literature:: Multi-step reaction with 8 steps

1.1: sodium methoxide / ethanol / 0.5 h / Heating

1.2: 48 percent / ethanol / 24 h / Heating

2.1: aq. HCl / 14 h / 75 °C

3.1: 52 percent / pyridine / 18 h / 20 °C

4.1: 74 percent / boron trichloride / CH₂Cl₂ / 0 - 20 °C

5.1: 48 percent / potassium carbonate / acetone / 12 h / Heating

6.1: 45 percent / NaOH / ethanol / 24 h / 20 °C

7.1: 87 percent / NaI / acetone / 12 h / Heating

8.1: 980 mg / 2 h / 130 °C

With pyridine; hydrogenchloride; sodium hydroxide; sodium methylate; boron trichloride; potassium carbonate; sodium iodide; In ethanol; dichloromethane; acetone;
DOI:10.1021/jo0008340

Reference yield:

: 329966-17-8
(2R)-3-(2,3-dimethoxyphenoxy)-1,2-propanediol

: 766498-48-0
(2S)-2-[((2-(2,6-dimethoxyphenoxy)ethyl)amino)methyl]-8-methoxy-1,4-benzodioxane

Guidance literature:: Multi-step reaction with 6 steps

1: 52 percent / pyridine / 18 h / 20 °C

2: 74 percent / boron trichloride / CH₂Cl₂ / 0 - 20 °C

3: 48 percent / potassium carbonate / acetone / 12 h / Heating

4: 45 percent / NaOH / ethanol / 24 h / 20 °C

5: 87 percent / NaI / acetone / 12 h / Heating

6: 980 mg / 2 h / 130 °C

With pyridine; sodium hydroxide; boron trichloride; potassium carbonate; sodium iodide; In ethanol; dichloromethane; acetone;
DOI:10.1021/jo0008340

Reference yield:

: 329966-16-7
(2S)-3-(2,3-dimethoxyphenoxy)-1,2-propanediol acetonide

: 766498-48-0
(2S)-2-[((2-(2,6-dimethoxyphenoxy)ethyl)amino)methyl]-8-methoxy-1,4-benzodioxane

Guidance literature:: Multi-step reaction with 7 steps

1: aq. HCl / 14 h / 75 °C

2: 52 percent / pyridine / 18 h / 20 °C

3: 74 percent / boron trichloride / CH₂Cl₂ / 0 - 20 °C

4: 48 percent / potassium carbonate / acetone / 12 h / Heating

5: 45 percent / NaOH / ethanol / 24 h / 20 °C

6: 87 percent / NaI / acetone / 12 h / Heating

7: 980 mg / 2 h / 130 °C

With pyridine; hydrogenchloride; sodium hydroxide; boron trichloride; potassium carbonate; sodium iodide; In ethanol; dichloromethane; acetone;
DOI:10.1021/jo0008340