Phenol, 4-[(dimethylamino)methyl]-2,6-dimethyl-

Base Information

• Chemical Name: Phenol, 4-[(dimethylamino)methyl]-2,6-dimethyl-
• CAS No.: 42900-95-8
• Molecular Formula: C11H17NO
• Molecular Weight: 179.262
• Hs Code.: 2922299090
• European Community (EC) Number: 255-991-4
• UNII: FJE3UJV3G6
• DSSTox Substance ID: DTXSID6068430
• Nikkaji Number: J309.998I
• Wikidata: Q81995162
• Mol file: 42900-95-8.mol

Synonyms:42900-95-8;Phenol, 4-[(dimethylamino)methyl]-2,6-dimethyl-;BRN 2719100;alpha(sup 4)-(Dimethylamino)mesitol;EINECS 255-991-4;2,6-Dimethyl-4-dimethylaminomethylphenol;MESITOL, alpha(sup 4)-(DIMETHYLAMINO)-;Phenol, 2,6-dimethyl-4-(dimethylaminomethyl)-;Phenol, 4-((dimethylamino)methyl)-2,6-dimethyl-;4-[(DIMETHYLAMINO)METHYL]-2,6-DIMETHYLPHENOL;4-((Dimethylamino)methyl)-2,6-xylenol;4-13-00-01944 (Beilstein Handbook Reference);4-[(dimethylamino)methyl]-2,6-xylenol;4-((DIMETHYLAMINO)METHYL)-2,6-DIMETHYLPHENOL;FJE3UJV3G6;N,N-dimethyl-4-aminomethyl-2,6-dimethylphenol;SCHEMBL1716900;DTXSID6068430;AKOS017263024;LS-89875;4-dimethylaminomethyl-2,6-dimethyl-phenol;2,6-dimethyl-4-(dimethylaminomethyl)phenol;(4-Hydroxy-3,5-dimethylbenzyl)dimethylamine;dimethyl(3,5-dimethyl-4-hydroxybenzyl)amine;FT-0711295;N,N-dimethyl,2,6-dimethyl-4-aminomethylphenol;2,6-dimethyl-4-(N,N-dimethylaminomethyl)-phenol;N,N-dimethyl-(3,5-dimethyl-4-hydroxybenzyl)amine

Chemical Property of Phenol, 4-[(dimethylamino)methyl]-2,6-dimethyl-

Chemical Property:

• Vapor Pressure: 0.00928mmHg at 25°C
• Boiling Point: 257°Cat760mmHg
• Flash Point: 101.4°C
• PSA: 23.47000
• Density: 1.012g/cm³
• LogP: 2.07060
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 179.131014166
• Heavy Atom Count: 13
• Complexity: 146

Purity/Quality:

98%min ^*data from raw suppliers

4-[(DIMETHYLAMINO)METHYL]-2,6-DIMETHYLPHENOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1O)C)CN(C)C

Technology Process of Phenol, 4-[(dimethylamino)methyl]-2,6-dimethyl-

There total 6 articles about Phenol, 4-[(dimethylamino)methyl]-2,6-dimethyl- 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: 97.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 2.6-dimethylphenol (576-26-1,25134-01-4) + dimethyl amine (124-40-3) → 4-[(dimethylamino)methyl]-2,6-dimethylphenol (42900-95-8)

Guidance literature:

In water; isopropyl alcohol; for 4h; Heating;

DOI:10.1021/jo00246a050

Reference yield: 78.0%

2.6-dimethylphenol (576-26-1,25134-01-4) + triethylsiloxymethyl-N,N-dimethylamine (1353053-97-0) → 4-[(dimethylamino)methyl]-2,6-dimethylphenol (42900-95-8)

Guidance literature:

at 20 ℃; Sealed tube;

DOI:10.1002/ejoc.201700902

Reference yield: 71.0%

4-Hydroxy-3,5-dimethyl-benzenesulfonic acid; compound with 4-dimethylaminomethyl-2,6-dimethyl-phenol (115198-18-0) → 4-[(dimethylamino)methyl]-2,6-dimethylphenol (42900-95-8) + sodium 2,6-dimethyl sulfonatophenol (15205-65-9)

Guidance literature:

With sodium hydroxide; In water; for 3h;

DOI:10.1007/BF00958336

upstream raw materials:

formaldehyd

2.6-dimethylphenol

dimethyl amine

(dimethylamino)methyl acetate

Downstream raw materials:

2-(3-tert-Butyl-4-hydroxy-5-methyl-benzyl)-2-(4-hydroxy-3,5-dimethyl-benzyl)-malonic acid dioctadecyl ester

2-(3,5-Di-tert-butyl-4-hydroxy-benzyl)-2-(4-hydroxy-3,5-dimethyl-benzyl)-malonic acid didodecyl ester

4-(2,4-Diamino-6-methylsulfanyl-pyrimidin-5-ylmethyl)-2,6-dimethyl-phenol

N,N-dimethyl-3-phenyl-2-propyn-1-amine