2-Dimethylaminomethyltetralone

Base Information

• Chemical Name: 2-Dimethylaminomethyltetralone
• CAS No.: 7353-59-5
• Molecular Formula: C13H17NO
• Molecular Weight: 203.2802
• DSSTox Substance ID: DTXSID10994305
• Nikkaji Number: J42.441B
• ChEMBL ID: CHEMBL3302886
• Mol file: 7353-59-5.mol

Synonyms:2-Dimethylaminomethyltetralone;7353-59-5;N-538;BRN 2106007;1-Dimethylaminomethyl-tetralon-2 [German];1-Dimethylaminomethyl-tetralon-2;2-[(DIMETHYLAMINO)METHYL]-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONE;1-Dimethylaminomethyl-3,4-dihydro-1(2H)-naphthalenone;2-((Dimethylamino)methyl)-3,4-dihydronaphthalen-1(2H)-one;2-[(dimethylamino)methyl]-3,4-dihydro-1(2H)-naphthalenone;2-[(dimethylamino)methyl]-3,4-dihydronaphthalen-1(2H)-one;2-[(Dimethylamino)methyl]tetralin-1-one;1(2H)-NAPHTHALENONE, 3,4-DIHYDRO-2-((DIMETHYLAMINO)METHYL)-;NSC656287;3-14-00-00192 (Beilstein Handbook Reference);SCHEMBL2125675;CHEMBL3302886;2-dimethylaminomethyl-1-tetralone;DTXSID10994305;MFCD01712557;2-(dimethylaminomethyl)tetralin-1-one;AKOS004121538;LS-95048;SY293179;CS-0455388;2-dimethylaminomethyl-3,4-dihydronaphthalen-1-one;AE-641/00202016;2-dimethylaminomethyl-3,4-dihydro-naphthalen-1-one;2-(dimethylaminomethyl)-3,4-dihydro-1-(2H)-naphthalenone

Chemical Property of 2-Dimethylaminomethyltetralone

Chemical Property:

• Vapor Pressure: 0.000702mmHg at 25°C
• Boiling Point: 308°Cat760mmHg
• Flash Point: 109.5°C
• PSA: 20.31000
• Density: 1.047g/cm³
• LogP: 1.99330
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 203.131014166
• Heavy Atom Count: 15
• Complexity: 237

Purity/Quality:

≥99.0% ^*data from raw suppliers

2-[(DIMETHYLAMINO)METHYL]-3,4-DIHYDRO-1(2H)-NAPHTHALENONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC1CCC2=CC=CC=C2C1=O

Technology Process of 2-Dimethylaminomethyltetralone

There total 7 articles about 2-Dimethylaminomethyltetralone 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: 86.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + dimethyl amine (124-40-3) + 3,4-dihydronaphthalene-1(2H)-one (529-34-0) → 2-dimethylaminomethyl-3,4-dihydro-naphthalen-1-one (7353-59-5)

Guidance literature:

With hydrogenchloride; In ethanol; at 90 ℃; for 24h;

DOI:10.7164/antibiotics.50.685

Reference yield: 72.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + N,N-dimethylammonium chloride (506-59-2) + 3,4-dihydronaphthalene-1(2H)-one (529-34-0) → 2-dimethylaminomethyl-3,4-dihydro-naphthalen-1-one (7353-59-5)

Guidance literature:

With hydrogenchloride; In isopropyl alcohol; at 90 - 95 ℃; for 5.25h; pH=4;

DOI:10.1016/j.bmc.2005.11.032

Reference yield:

N,N-dimethylammonium chloride (506-59-2) + 3,4-dihydronaphthalene-1(2H)-one (529-34-0) → 2-dimethylaminomethyl-3,4-dihydro-naphthalen-1-one (7353-59-5)

Guidance literature:

With potassium carbonate; paraformaldehyde; In water; acetic acid;

upstream raw materials:

formaldehyd

N,N-dimethylammonium chloride

3,4-dihydronaphthalene-1(2H)-one

1-(3,4-dihydro-1-naphthalenyl)pyrrolidine

Downstream raw materials:

2-(2-oxo-2-phenylethyl)-3,4-dihydronaphthalen-1(2H)-one

2-[4-(2-benzhydryloxy-ethyl)-piperazin-1-ylmethyl]-3,4-dihydro-2H-naphthalen-1-one

2-(4-{2-[bis-(4-fluoro-phenyl)-methoxy]-ethyl}-piperazin-1-ylmethyl)-3,4-dihydro-2H-naphthalen-1-one

E-(2RS)-[1-(2-Methoxybenzylidene)-1,2,3,4-tetrahydro-naphth-2-ylmethyl]-dimethylamine hydrochloride