trans-4-(Dimethylamino)cyclohexanol

Base Information

• Chemical Name: trans-4-(Dimethylamino)cyclohexanol
• CAS No.: 103023-51-4
• Molecular Formula: C₈H₁₇NO
• Molecular Weight: 143.229
• Hs Code.: 2922190090
• European Community (EC) Number: 812-170-0
• DSSTox Substance ID: DTXSID001293915
• Nikkaji Number: J1.140.457J,J1.140.462F
• Mol file: 103023-51-4.mol

Synonyms:4-(Dimethylamino)cyclohexanol;trans-4-(Dimethylamino)cyclohexanol;61168-09-0;103023-51-4;Cis-4-(dimethylamino)cyclohexanol;103023-50-3;(1r,4r)-4-(Dimethylamino)cyclohexanol;4-(DIMETHYLAMINO) CYCLOHEXANOL;4-(dimethylamino)cyclohexan-1-ol;MFCD09037891;MFCD09258736;Cyclohexanol,4-(dimethylamino)-,trans-;Cyclohexanol, 4-(dimethylamino)-, cis-;4-Dimethylaminocyclohexanol;SCHEMBL4163043;SCHEMBL8272501;SCHEMBL10343614;SCHEMBL15115921;STNVXNYQNKDYBT-UHFFFAOYSA-N;STNVXNYQNKDYBT-ZKCHVHJHSA-N;DTXSID001293915;BCP04541;MFCD09998817;4-Hydroxy-N,N-dimethylcyclohexylamine;AKOS006332097;AKOS006345992;AKOS027328255;AM10850;CS-W003581;SB84079;SB85269;trans-4-(dimethylamino)cyclohexan-1-ol;AC-33809;AS-18446;AS-20140;AS-30318;SY025154;SY029606;(1s,4s)-4-(dimethylamino)cyclohexan-1-ol;DB-361752;CS-0416114;A833070;A896646;J-000857

Chemical Property of trans-4-(Dimethylamino)cyclohexanol

Chemical Property:

• Boiling Point: 216.4°Cat760mmHg
• PKA: 15.12±0.40(Predicted)
• Flash Point: 86.1°C
• PSA: 23.47000
• Density: 0.97g/cm³
• LogP: 0.85150
• Storage Temp.: 2-8°C
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 143.131014166
• Heavy Atom Count: 10
• Complexity: 95.4

Purity/Quality:

≥95% ^*data from raw suppliers

trans-4-(Dimethylamino)cyclohexanol 97.0% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1CCC(CC1)O

Technology Process of trans-4-(Dimethylamino)cyclohexanol

There total 6 articles about trans-4-(Dimethylamino)cyclohexanol 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:

→ N,N-dimethyl-cyclohexanamine (98-94-2) + 4-(dimethylamino)cyclohexanol (103023-50-3,103023-51-4,61168-09-0)

Guidance literature:

With water; platinum; under 2280 Torr; Hydrogenation_.entsteht ein Gemisch der diastereoisomeren Formen;

Reference yield:

4-(N,N-dimethylamino)phenol (619-60-3) + water (7732-18-5) → N,N-dimethyl-cyclohexanamine (98-94-2) + 4-(dimethylamino)cyclohexanol (103023-50-3,103023-51-4,61168-09-0)

Guidance literature:

under 2280 Torr; Reaktion des Hydrochlorids_.Hydrogenation;

Reference yield:

trans-N-acetyl-4-hydroxycyclohexylamine (23363-88-4) → 4-(dimethylamino)cyclohexanol (103023-50-3,103023-51-4,61168-09-0)

Guidance literature:

With potassium hydroxide; Hydrolysis_.anschliessenden Reaktion mit Formaldehyd und Ameisensaeure;

DOI:10.1021/jo01361a003

upstream raw materials:

trans-N-acetyl-4-hydroxycyclohexylamine

formaldehyd

4-(N,N-dimethylamino)phenol

water

Downstream raw materials:

N,N,N-trimethyl-4-(thiophen-3-ylmethylene)cyclohexanaminium bromide

4-(dimethylamino)cyclohexanone

Refernces

• 1、 Denmark, Scott E.,Forbes, David C.,Hays, David S.,DePue, Jeffrey S.,Wilde, Richard G.. "Catalytic Epoxidation of Alkenes with Oxone". . p. 1391 - 1407. Retrieved 2007/10/02.