8-Methoxy-2-acetamidotetralin

Base Information

• Chemical Name: 8-Methoxy-2-acetamidotetralin
• CAS No.: 80270-68-4
• Molecular Formula: C₁₃H₁₇NO₂
• Molecular Weight: 219.283
• DSSTox Substance ID: DTXSID90934704
• Nikkaji Number: J573.629C
• ChEMBL ID: CHEMBL53015
• Mol file: 80270-68-4.mol

Synonyms:2-acetamido-8-methoxytetralin;2-AMTT;8-methoxy-2-acetamidotetralin;AH 001;AH-001;AH001

Chemical Property of 8-Methoxy-2-acetamidotetralin

Chemical Property:

• Boiling Point: 439.7°Cat760mmHg
• PKA: 15.87±0.20(Predicted)
• Flash Point: 219.7°C
• PSA: 41.82000
• Density: 1.11g/cm³
• LogP: 2.52890
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 219.125928785
• Heavy Atom Count: 16
• Complexity: 254

Purity/Quality:

98%min ^*data from raw suppliers

N-(1,2,3,4-Tetrahydro-8-methoxy-2-naphthalenyl)acetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1CCC2=C(C1)C(=CC=C2)OC

Technology Process of 8-Methoxy-2-acetamidotetralin

There total 6 articles about 8-Methoxy-2-acetamidotetralin 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: 79.0%

acetic anhydride (108-24-7) + 8-Methoxy-(2R)-2-amino-1,2,3,4-tetrahydronaphthalene hydrochloride (3880-76-0) → N-(1,2,3,4-tetrahydro,8-methoxy-2-naphthalenyl)-acetamide (80270-68-4,153221-21-7)

Guidance literature:

With sodium acetate; In water; ethyl acetate; for 3h;

DOI:10.1021/jm00072a008

Reference yield: 56.0%

8-methoxy-2-aminotetralin (3880-77-1,127253-44-5) + acetyl chloride (75-36-5) → N-(1,2,3,4-tetrahydro,8-methoxy-2-naphthalenyl)-acetamide (80270-68-4,153221-21-7)

Guidance literature:

With triethylamine; In dichloromethane; for 1h; Ambient temperature;

DOI:10.1021/jm960219h

Reference yield:

8-methoxy-2-tetralone (5309-19-3) + N-methoxylamine hydrochloride (593-56-6) → N-(1,2,3,4-tetrahydro,8-methoxy-2-naphthalenyl)-acetamide (80270-68-4,153221-21-7)

Guidance literature:

With hydrogenchloride; sodium hydroxide; borane; In tetrahydrofuran; ethanol; dichloromethane;

upstream raw materials:

acetic anhydride

8-Methoxy-(2R)-2-amino-1,2,3,4-tetrahydronaphthalene hydrochloride

8-methoxy-2-aminotetralin

acetyl chloride

Downstream raw materials:

N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

(S)-N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

N-<1,2,3,4-tetrahydro-8-methoxy-5-(phenylthio)-2-naphthalenyl>acetamide

1,2,3,4-tetrahydro-8-methoxy-N-ethyl-5-(phenylthio)-2-naphthalenamine hydrochloride