2-Aminocyclohexanol

Base Information

• Chemical Name: 2-Aminocyclohexanol
• CAS No.: 6850-38-0
• Molecular Formula: C6H13NO
• Molecular Weight: 115.175
• Hs Code.: 2922199090
• European Community (EC) Number: 640-699-5
• DSSTox Substance ID: DTXSID60902516
• Nikkaji Number: J81.283H
• Mol file: 6850-38-0.mol

Synonyms:2-Aminocyclohexanol;2-Hydroxycyclohexylamine;

Chemical Property of 2-Aminocyclohexanol

Chemical Property:

• Melting Point: 65 °C
• Boiling Point: 201.1 °C at 760 mmHg
• PKA: 14.94±0.40(Predicted)
• Flash Point: 75.4 °C
• PSA: 46.25000
• Density: 1.037 g/cm³
• LogP: 0.94890
• Storage Temp.: 0-10°C
• Solubility.: soluble in Methanol
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 115.099714038
• Heavy Atom Count: 8
• Complexity: 74.9

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Aminocyclohexanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 34-22
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C(C1)N)O
• Uses: Trans-2-aminocyclohexanol and cis-/trans-1,2-cyclohexanediamines have found their application in the synthesis of the antiarrhythmic medicament vernakalant and spleen tyrosine kinase inhibitor, κ-opioid analgesics.

Technology Process of 2-Aminocyclohexanol

There total 103 articles about 2-Aminocyclohexanol 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: 98.0%

trans-1-azido-2-(trimethylsilyloxy)cyclohexane → (+/-)-trans-2-aminocyclohexanol (931-16-8,6850-38-0,6982-39-4,33092-82-9,38898-70-3,74111-21-0,108267-20-5,931-15-7)

Guidance literature:

With formic acid; Pd/Al₂O₃; In ethyl acetate; at 30 ℃; for 18h; Green chemistry;

DOI:10.1039/c3gc40988k

Reference yield: 96.0%

cyclohexane-1,2-epoxide (286-20-4) → (+/-)-trans-2-aminocyclohexanol (931-16-8,6850-38-0,6982-39-4,33092-82-9,38898-70-3,74111-21-0,108267-20-5,931-15-7)

Guidance literature:

With ammonium hydroxide; 5 deg C -> 25 deg C, overnight;

DOI:10.1002/ardp.19933260711

Reference yield: 95.0%

trans-2-azido-1-cyclohexanol → (+/-)-trans-2-aminocyclohexanol (931-16-8,6850-38-0,6982-39-4,33092-82-9,38898-70-3,74111-21-0,108267-20-5,931-15-7)

Guidance literature:

With sodium tetrahydroborate; cetyltrimethylammonim bromide; cobalt(II) chloride; In water; at 25 ℃; for 0.166667h;

DOI:10.1055/s-2000-6389

upstream raw materials:

cyclohexane-1,2-epoxide

2-azido cyclohexanol

trans-2-chlorocyclohexanol

ammonia

Downstream raw materials:

(±)-N-((1R,2R)-2-hydroxycyclohexyl)acetamide

(+/-)-trans-2-acetylamino-1-acetoxy-cyclohexane

trans-2-(N-phenylcarbonylamino)-1-cyclohexanol

C₈H₁₈NO₃P