1-(Propan-2-yl)azetidin-3-amine dihydrochloride

Base Information

• Chemical Name: 1-(Propan-2-yl)azetidin-3-amine dihydrochloride
• CAS No.: 117546-56-2
• Molecular Formula: C₆H₁₄N₂*2ClH
• Molecular Weight: 187.112
• Hs Code.: 2933998090
• European Community (EC) Number: 842-993-0
• Mol file: 117546-56-2.mol

Synonyms:117546-56-2;1-(propan-2-yl)azetidin-3-amine dihydrochloride;1-isopropylazetidin-3-amine dihydrochloride;1-(Propan-2-yl)azetidin-3-amine 2HCl;1-propan-2-ylazetidin-3-amine;dihydrochloride;MFCD22422840;3-Azetidinamine, 1-(1-methylethyl)-, dihydrochloride;SCHEMBL2920993;ZVQXPRGZMDSQAO-UHFFFAOYSA-N;AMY33687;AKOS015900927;SB11180;1-isopropylazetidin-3-aminedihydrochloride;AS-33925;SY042344;CS-0052806;EN300-155699;1-(1-Methylethyl)-3-azetidinamine HCl (1:2);A893335;1-(1-Methylethyl)-3-azetidinamine, dihydrochloride;3-Azetidinamine, 1-(1-methylethyl)-hydrochloride (1:2)

Chemical Property of 1-(Propan-2-yl)azetidin-3-amine dihydrochloride

Chemical Property:

• PSA: 0.00000
• LogP: 0.00000
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 186.0690539
• Heavy Atom Count: 10
• Complexity: 74.6

Purity/Quality:

99%, ^*data from raw suppliers

1-(Propan-2-yl)azetidin-3-amineDihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)N1CC(C1)N.Cl.Cl

Technology Process of 1-(Propan-2-yl)azetidin-3-amine dihydrochloride

There total 4 articles about 1-(Propan-2-yl)azetidin-3-amine dihydrochloride 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:

3-aminoazetidine-1-carboxylic acid tert-butyl ester (193269-78-2) + acetone (67-64-1) → 1-isopropylazetidin-3-amine dihydrochloride (117546-56-2)

Guidance literature:

3-aminoazetidine-1-carboxylic acid tert-butyl ester; acetone; With sodium tris(acetoxy)borohydride; In ethanol; dichloromethane; at 20 ℃; for 20h;

With hydrogenchloride; In tert-butyl methyl ether; isopropyl alcohol; at 48 - 50 ℃; for 0.75h;

Reference yield:

C11H22N2O2 → 1-isopropylazetidin-3-amine dihydrochloride (117546-56-2)

Guidance literature:

With hydrogenchloride; In methanol; isopropyl alcohol; at 50 ℃; for 3.75h; Large scale;

DOI:10.1021/op500072b

Reference yield:

3-aminoazetidine-1-carboxylic acid tert-butyl ester (193269-78-2) → 1-isopropylazetidin-3-amine dihydrochloride (117546-56-2)

Guidance literature:

Multi-step reaction with 3 steps

1: hydrogenchloride / water; methanol

2: sodium tris(acetoxy)borohydride / ethanol; dichloromethane / 21.5 h / 20 °C / Large scale

3: hydrogenchloride / methanol; isopropyl alcohol / 3.75 h / 50 °C / Large scale

With hydrogenchloride; sodium tris(acetoxy)borohydride; In methanol; ethanol; dichloromethane; water; isopropyl alcohol;

DOI:10.1021/op500072b

upstream raw materials:

3-aminoazetidine-1-carboxylic acid tert-butyl ester

acetone

tert-butyl 3-aminoazetidine-1-carboxylate hydrochloride

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