2-[(Dimethylamino)methyl]cyclohexan-1-ol

Base Information

• Chemical Name: 2-[(Dimethylamino)methyl]cyclohexan-1-ol
• CAS No.: 17589-70-7
• Molecular Formula: C9H19NO
• Molecular Weight: 157.256
• DSSTox Substance ID: DTXSID201288110
• Mol file: 17589-70-7.mol

Synonyms:17589-70-7;2-[(dimethylamino)methyl]cyclohexan-1-ol;2-((Dimethylamino)methyl)cyclohexanol;2-[(dimethylamino)methyl]cyclohexanol;NSC638641;2-(dimethylaminomethyl)cyclohexanol;Cyclohexanol, 2-[(dimethylamino)methyl]-;Enamine_005634;SCHEMBL5342502;DTXSID201288110;HMS1410A02;AKOS003587937;AKOS017268831;IDI1_007869;EN300-60880;2-((Dimethylamino)methyl)cyclohexanol hydrochloride

Chemical Property of 2-[(Dimethylamino)methyl]cyclohexan-1-ol

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 157.146664230
• Heavy Atom Count: 11
• Complexity: 114

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC1CCCCC1O

Technology Process of 2-[(Dimethylamino)methyl]cyclohexan-1-ol

There total 1 articles about 2-[(Dimethylamino)methyl]cyclohexan-1-ol 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%

2-[(dimethylamino)methyl]cyclohexanone (769092-24-2) → 2-(dimethylaminomethyl)cyclohexanol (17589-70-7)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether;

DOI:10.1135/cccc19851078

Reference yield: 66.0%

2-(dimethylaminomethyl)cyclohexanol (17589-70-7) + benzoyl chloride (98-88-4) → (+/-)-benzoic acid-(trans-2-dimethylaminomethyl-cyclohexyl ester); hydrochloride (101255-62-3) + (+/-)-benzoic acid-(cis-2-dimethylaminomethyl-cyclohexyl ester); hydrochloride (101255-62-3)

Guidance literature:

In benzene; 1.) reflux, 2.) r.t., 2 h;

Reference yield: 64.0%

2-(dimethylaminomethyl)cyclohexanol (17589-70-7) → N,N-dimethyl-1-cyclohexenylmethylamine (31171-59-2) + 2-(dimethylaminomethyl)cyclohexyl chloride (101236-78-6)

Guidance literature:

With thionyl chloride; In benzene; Yields of byproduct given;

DOI:10.1135/cccc19851078

upstream raw materials:

2-[(dimethylamino)methyl]cyclohexanone

Downstream raw materials:

2-(dimethylaminomethyl)cyclohexyl chloride

(2-bromo-cyclohexylmethyl)-dimethyl-amine

N,N-dimethyl-1-cyclohexenylmethylamine

(+/-)-benzoic acid-(trans-2-dimethylaminomethyl-cyclohexyl ester); hydrochloride