trans-2-Aminomethyl-1-cyclohexanol

Base Information

• Chemical Name: trans-2-Aminomethyl-1-cyclohexanol
• CAS No.: 133269-86-0
• Molecular Formula: C7H15NO
• Molecular Weight: 129.202
• European Community (EC) Number: 632-632-3
• DSSTox Substance ID: DTXSID301347860,DTXSID001347861
• Nikkaji Number: J357.590J
• Mol file: 133269-86-0.mol

Synonyms:5691-09-8;TRANS-2-AMINOMETHYL-1-CYCLOHEXANOL;133269-86-0;(1R,2S)-2-(aminomethyl)cyclohexanol;(1R,2S)-2-(aminomethyl)cyclohexan-1-ol;trans-2-Aminomethyl-cyclohexanol;(1R,2S)-()-trans-2-(Aminomethyl)cyclohexanol;trans-2-(aminomethyl)cyclohexanol;SCHEMBL1413545;DTXSID001347861;DTXSID301347860;2-(Aminomethyl)cyclohexanol, (E)-;MFCD06213163;AKOS006238601;Cyclohexanol, 2-(aminomethyl)-, trans-;rel-(1R,2S)-2-(Aminomethyl)cyclohexanol;(1R)-2alpha-Aminomethylcyclohexan-1beta-ol;CS-0055058;EN300-246287;(1R,2S)-(-)-trans-2-(Aminomethyl)cyclohexanol, 97%

Chemical Property of trans-2-Aminomethyl-1-cyclohexanol

Chemical Property:

• PSA: 46.25000
• LogP: 1.19650
• Storage Temp.: 2-8°C
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 129.115364102
• Heavy Atom Count: 9
• Complexity: 85

Purity/Quality:

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

(1R,2S)-2-(Aminomethyl)cyclohexanol 95+% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCC(C(C1)CN)O
• Isomeric SMILES: C1CC[C@H]([C@@H](C1)CN)O
• Uses: (1s,2r)-2-(Aminomethyl)cyclohexan-1-ol can be used as anti-infective agents.

Technology Process of trans-2-Aminomethyl-1-cyclohexanol

There total 3 articles about trans-2-Aminomethyl-1-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: 90.0%

(1S,2R)-trans-2-hydroxycyclohexanecarbonitrile (125356-61-8,125291-55-6) → (1R,2S)-2-(aminomethyl)cyclohexanol (133269-86-0)

Guidance literature:

With ammonia; hydrogen; nickel; In methanol; at 50 ℃; for 90h; under 36775.4 Torr;

Reference yield:

trans-2-(aminomethyl)cyclohexanol (109087-14-1) → (+)-trans-1-Aminomethyl-cyclohexanol-(2) (5691-09-8,28250-37-5,60659-10-1,109087-13-0,109087-14-1,133269-86-0,133269-87-1)

Guidance literature:

With L-Tartaric acid;

Reference yield:

→ (1R,2S)-2-(aminomethyl)cyclohexanol (133269-86-0)

Guidance literature:

trans-2-Hydroxycyclohexancarboxamid X m.LiAlH4;

upstream raw materials:

(1S,2R)-trans-2-hydroxycyclohexanecarbonitrile

trans-2-(aminomethyl)cyclohexanol

Downstream raw materials:

C₂₅H₃₃F₃N₄O₂

Refernces