(betaS)-3,4-Dimethoxy-beta-methylbenzeneethanamine

Base Information

Chemical Name:(betaS)-3,4-Dimethoxy-beta-methylbenzeneethanamine
CAS No.:64265-63-0
Molecular Formula:C₁₁H₁₇NO₂
Molecular Weight:195.261
Hs Code.:
DSSTox Substance ID:DTXSID801257486

Synonyms:64265-63-0;(betaS)-3,4-Dimethoxy-beta-methylbenzeneethanamine;SCHEMBL1024752;DTXSID801257486;(2S)-2-(3,4-dimethoxyphenyl)propan-1-amine;EN300-6506833

Suppliers and Price of (betaS)-3,4-Dimethoxy-beta-methylbenzeneethanamine

Supply Marketing:

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

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Chemical Property of (betaS)-3,4-Dimethoxy-beta-methylbenzeneethanamine

Chemical Property:

XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:195.125928785
Heavy Atom Count:14
Complexity:163

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(CN)C1=CC(=C(C=C1)OC)OC
Isomeric SMILES:C[C@H](CN)C1=CC(=C(C=C1)OC)OC

Technology Process of (betaS)-3,4-Dimethoxy-beta-methylbenzeneethanamine

There total 6 articles about (betaS)-3,4-Dimethoxy-beta-methylbenzeneethanamine 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: 91.0%

: 110117-96-9
N-((S)-α-methylbenzyl)-2(S)-(3,4-dimethoxyphenyl)propylamine

: 64265-63-0
(S)-2-(3,4-dimethoxyphenyl)-propan-1-amine

Guidance literature:: With 20 % Pd(OH)2/C; hydrogen;
DOI:10.1021/jm1006758

Reference yield:

: 110117-97-0
N-((R)-α-methylbenzyl)-2(S)-(3,4-dimethoxyphenyl)propylamine

: 64265-63-0
(S)-2-(3,4-dimethoxyphenyl)-propan-1-amine

Guidance literature:: With hydrogen; palladium dihydroxide; In methanol; for 24h; under 2585.7 Torr;
DOI:10.1021/jm00393a039

Reference yield:

: 93-40-3
(3,4-Dimethoxyphenyl)acetic acid

: 64265-63-0
(S)-2-(3,4-dimethoxyphenyl)-propan-1-amine

Guidance literature:: Multi-step reaction with 5 steps

1: 1.) LDA / 1.) THF, hexane, 25 deg C, 15 min, 2.) THF, hexane, overnight

2: SOCl₂ / benzene / 3 h / Heating

3: pyridine / benzene / 0.25 h

4: 1 M BH₃ / tetrahydrofuran / 72 h / 25 °C

5: H₂ / Pearlman's catalyst / methanol / 24 h / 2585.7 Torr

With pyridine; thionyl chloride; borane; hydrogen; lithium diisopropyl amide; palladium dihydroxide; In tetrahydrofuran; methanol; benzene;
DOI:10.1021/jm00393a039