7-Methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline

Base Information

• Chemical Name: 7-Methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
• CAS No.: 41565-95-1
• Molecular Formula: C₁₁H₁₅NO
• Molecular Weight: 177.246
• European Community (EC) Number: 874-695-1
• ChEMBL ID: CHEMBL97707
• Nikkaji Number: J2.016.649E

Synonyms:7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline;41565-95-1;CHEMBL97707;1-methyl-7-methoxy-1,2,3,4-tetrahydroisoquinoline;SCHEMBL1010321;VMIDQQQAEQXCDJ-UHFFFAOYSA-N;MFCD09886930;AKOS009118665;NS-01504;CS-0452290;EN300-197781;G75834;A929334;1,2,3,4-tetrahydro-7-methoxy-1-methyl-Isoquinoline;1-Methyl-7-methoxy-1,2,3,4-tetrahydro-isoquinoline;7-Methoxy-1-methyl-1,2,3,4-tetrahydro-isoquinoline;InChI=1/C11H15NO/c1-8-11-7-10(13-2)4-3-9(11)5-6-12-8/h3-4,7-8,12H,5-6H2,1-2H

Chemical Property of 7-Methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 177.115364102
• Heavy Atom Count: 13
• Complexity: 172

Purity/Quality:

97% ^*data from raw suppliers

7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1C2=C(CCN1)C=CC(=C2)OC

Technology Process of 7-Methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline

There total 4 articles about 7-Methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline 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: 88.0%

7-methoxy-1-methyl-3,4-dihydroisoquinoline (138976-84-8) → Methoxy-7 methyl-1 tetrahydro-1,2,3,4 isoquinoleine (41565-95-1)

Guidance literature:

With sodium tetrahydroborate; In ethanol;

DOI:10.1016/S0960-894X(03)00583-3

Reference yield:

N-(4-methoxyphenylethyl)acetamide (54815-19-9) → Methoxy-7 methyl-1 tetrahydro-1,2,3,4 isoquinoleine (41565-95-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 36 percent / P₂O₅; POCl₃ / toluene / Heating

2: 88 percent / NaBH₄ / ethanol

With sodium tetrahydroborate; phosphorus pentoxide; trichlorophosphate; In ethanol; toluene;

DOI:10.1016/S0960-894X(03)00583-3

Reference yield:

4-Methoxyphenethylamine (55-81-2) → Methoxy-7 methyl-1 tetrahydro-1,2,3,4 isoquinoleine (41565-95-1)

Guidance literature:

Multi-step reaction with 3 steps

1: 72 percent / pyridine / CH₂Cl₂

2: 36 percent / P₂O₅; POCl₃ / toluene / Heating

3: 88 percent / NaBH₄ / ethanol

With pyridine; sodium tetrahydroborate; phosphorus pentoxide; trichlorophosphate; In ethanol; dichloromethane; toluene;

DOI:10.1016/S0960-894X(03)00583-3

upstream raw materials:

7-methoxy-1-methyl-3,4-dihydroisoquinoline

N-(4-methoxyphenylethyl)acetamide

4-Methoxyphenethylamine

Downstream raw materials:

C₂₄H₂₆FN₃O*ClH

C₂₆H₃₀FN₃O*ClH

C₂₆H₂₈FN₃O*ClH

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