Dodecan-2-amine

Base Information

• Chemical Name: Dodecan-2-amine
• CAS No.: 13865-46-8
• Molecular Formula: C12H27 N
• Molecular Weight: 185.353
• Hs Code.: 2921199090
• European Community (EC) Number: 237-612-4
• DSSTox Substance ID: DTXSID00930176
• Nikkaji Number: J280.347J
• Mol file: 13865-46-8.mol

Synonyms:dodecan-2-amine;1-Methylundecylamine;13865-46-8;2-Dodecanamine;EINECS 237-612-4;2-Aminododecan;2-amino dodecane;SCHEMBL458142;DTXSID00930176;CS-0224543;EN300-119896

Chemical Property of Dodecan-2-amine

Chemical Property:

• Vapor Pressure: 0.0226mmHg at 25°C
• Boiling Point: 249.7°Cat760mmHg
• Flash Point: 103.8°C
• PSA: 26.02000
• Density: 0.803g/cm³
• LogP: 4.56470
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 9
• Exact Mass: 185.214349865
• Heavy Atom Count: 13
• Complexity: 91.1

Purity/Quality:

98%Min ^*data from raw suppliers

DODECAN-2-AMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCC(C)N

Technology Process of Dodecan-2-amine

There total 6 articles about Dodecan-2-amine 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: 73.0%

2-chlorododecan-1-amine (59590-10-2) → 2-dodecylamine (13865-46-8)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; at 0 ℃; regioselective reaction; Reflux;

DOI:10.1126/science.aat3863

Reference yield:

rac-2-dodecanol (10203-28-8) → 2-dodecylamine (13865-46-8)

Guidance literature:

With carbonylchlorohydrido(4,5-bis((diisopropylphosphino)methyl)acridine)ruthenium(II); ammonia; In tert-Amyl alcohol; at 20 - 170 ℃; for 48h; under 11251.1 - 15001.5 Torr; Inert atmosphere; Autoclave;

Reference yield:

dodecan-2-one (6175-49-1) → 2-dodecylamine (13865-46-8)

Guidance literature:

Multi-step reaction with 2 steps

1: NH₂OH / ethanol

2: H₂ / Raney-Ni / ethanol

With hydrogen; hydroxylamine; nickel; In ethanol;

DOI:10.1021/ja00791a037

upstream raw materials:

formic acid

dodecan-2-one

n-dodec-2-yloxime

rac-2-dodecanol

Refernces

• 1、 Legnani, Luca,Prina-Cerai, Gabriele,Delcaillau, Tristan,Willems, Suzanne,Morandi, Bill. "Efficient access to unprotected primary amines by iron-catalyzed aminochlorination of alkenes". . p. 434 - 439. Retrieved 2018/11/21.