5-Amino-3,4-dihydronaphthalen-1(2H)-one

Base Information

• Chemical Name: 5-Amino-3,4-dihydronaphthalen-1(2H)-one
• CAS No.: 41823-28-3
• Molecular Formula: C10H11NO
• Molecular Weight: 161.203
• DSSTox Substance ID: DTXSID20467696
• Nikkaji Number: J37.373G
• Wikidata: Q82294746
• Mol file: 41823-28-3.mol

Synonyms:5-AMINO-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE;41823-28-3;5-amino-3,4-dihydro-2H-naphthalen-1-one;5-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-1-ONE;1(2H)-Naphthalenone, 5-amino-3,4-dihydro-;5-Amino-1-tetralon;5-amino-1-tetralone;5-AMINO-3,4-DIHYDRO-1(2H)-NAPHTHALENONE;SCHEMBL2768935;DTXSID20467696;AKOS006286711;MB05790;AM20120515;CS-0309378;FT-0692672;EN300-180164;Z1198176542

Chemical Property of 5-Amino-3,4-dihydronaphthalen-1(2H)-one

Chemical Property:

• Melting Point: 119-120℃
• PSA: 43.09000
• LogP: 2.36900
• Storage Temp.: 2-8°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 161.084063974
• Heavy Atom Count: 12
• Complexity: 190

Purity/Quality:

97% ^*data from raw suppliers

5-Amino-3,4-dihydronaphthalen-1(2H)-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC2=C(C=CC=C2N)C(=O)C1

Technology Process of 5-Amino-3,4-dihydronaphthalen-1(2H)-one

There total 13 articles about 5-Amino-3,4-dihydronaphthalen-1(2H)-one 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: 96.0%

5-nitro-1-tetralone (51114-73-9) → 5-amino-3,4-dihydronaphthalen-1(2H)-one (41823-28-3)

Guidance literature:

With phenylsilane; triphenylphosphine; sodium iodide; In chloroform; at 60 ℃; for 72h; Inert atmosphere; Irradiation;

DOI:10.1021/acs.orglett.1c01654

Reference yield: 81.0%

5-nitro-1-tetralone (51114-73-9) + iron (7439-89-6) → 5-amino-3,4-dihydronaphthalen-1(2H)-one (41823-28-3)

Guidance literature:

With ammonium chloride; In methanol; water;

Reference yield: 81.0%

5-amino-1-naphthol (83-55-6) → 5-amino-3,4-dihydronaphthalen-1(2H)-one (41823-28-3)

Guidance literature:

With aluminum tri-bromide; cyclohexane; at 110 ℃; for 40h;

DOI:10.1016/S0040-4020(02)00512-4

upstream raw materials:

5-nitro-1-tetralone

6-mercapto-5-nitro-3,4-dihydro-1(2H)-naphthalenone

tetralin

5-amino-1-naphthol

Downstream raw materials:

5-chloro-3,4-dihydro-1(2H)-naphthalenone

N-benzyl-N-(5-cyano-7,8-dihydronaphthalen-1-yl)methanesulfonamide

N-benzyl-N-(5-oxo-5,6,7,8-tetrahydronaphthalen-1-yl)methanesulfonamide