(1R,2R)-2-(Propylamino)cyclohexanol

Base Information

• Chemical Name: (1R,2R)-2-(Propylamino)cyclohexanol
• CAS No.: 60093-74-5
• Molecular Formula: C₉H₁₉NO
• Molecular Weight: 157.256
• DSSTox Substance ID: DTXSID40574174
• Wikidata: Q82463125
• Mol file: 60093-74-5.mol

Synonyms:60093-74-5;(1R,2R)-2-(PROPYLAMINO)CYCLOHEXANOL;(1R,2R)-2-(Propylamino)cyclohexan-1-ol;trans-2-(propylamino)cyclohexanol;DTXSID40574174;MFCD18533364;AKOS000430755;BS-38325

Chemical Property of (1R,2R)-2-(Propylamino)cyclohexanol

Chemical Property:

• Vapor Pressure: 0.00374mmHg at 25°C
• Boiling Point: 249.1°C at 760 mmHg
• Flash Point: 84.3°C
• PSA: 32.26000
• Density: 0.95g/cm³
• LogP: 1.68040
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 157.146664230
• Heavy Atom Count: 11
• Complexity: 106

Purity/Quality:

98% ^*data from raw suppliers

trans-2-(propylamino)cyclohexanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCNC1CCCCC1O
• Isomeric SMILES: CCCN[C@@H]1CCCC[C@H]1O

Technology Process of (1R,2R)-2-(Propylamino)cyclohexanol

There total 5 articles about (1R,2R)-2-(Propylamino)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: 94.0%

propylamine (107-10-8,42939-71-9) + cyclohexane-1,2-epoxide (286-20-4) → trans-2-(propylamino)cyclohexan-1-ol (60093-74-5,66179-67-7)

Guidance literature:

With magnesium oxide; at 80 ℃; for 3h;

DOI:10.1139/V07-135

Reference yield:

trans-2-(propylamino)cyclohexan-1-ol (60093-74-5,66179-67-7) → (1R)-trans-2-Propylamino-cyclohexanol-(1) (60093-74-5,66179-67-7)

Guidance literature:

With L-Tartaric acid;

Reference yield:

trans-2-(propylamino)cyclohexan-1-ol (60093-74-5,66179-67-7) → (1S)-trans-2-Propylamino-cyclohexanol-(1) (60093-74-5,66179-67-7)

Guidance literature:

With L-Tartaric acid;

upstream raw materials:

trans-2-(propylamino)cyclohexan-1-ol

cyclohexane-1,2-epoxide

propylamine

Downstream raw materials:

(1R)-trans-2-Propylamino-cyclohexanol-⁽¹⁾

(1S)-trans-2-Propylamino-cyclohexanol-⁽¹⁾