Azetidin-3-amine dihydrochloride

Base Information

• Chemical Name: Azetidin-3-amine dihydrochloride
• CAS No.: 102065-89-4
• Molecular Formula: C3H8N2·2(HCl)
• Molecular Weight: 145.032
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID40542111
• Mol file: 102065-89-4.mol

Synonyms:Azetidin-3-amine dihydrochloride;102065-89-4;3-Aminoazetidine dihydrochloride;3-Aminoazetidine 2HCl;3-AMINO-AZETIDINE 2HCL;azetidin-3-amine;dihydrochloride;MFCD09910173;3-Azetidinamine, hydrochloride (1:2);Azetidin-3-amine,dihydrochloride;3-Azetidinamine 2HCl;3-Aminoazetidine diHCl;Azetidin-3-aminedihydrochloride;SCHEMBL6578886;3-aminoazetidine dihydro-chloride;DTXSID40542111;OOSDLMAZIRAMDN-UHFFFAOYSA-N;SC3251;AKOS015844826;CS-W022573;PB22346;AC-24374;AS-54646;SY033587;3-Aminoazetidine dihydrochloride, AldrichCPR;Azetidin-3-amine--hydrogen chloride (1/2);EN300-211419;J-519611;3- yen cent yenss yenI yen cent yen(1/4) yenA yen yeno2 per thousandcEa per thousandc

Chemical Property of Azetidin-3-amine dihydrochloride

Chemical Property:

• Vapor Pressure: 0.297mmHg at 25°C
• Melting Point: 162-163 °C
• Boiling Point: 198.8 °C at 760 mmHg
• Flash Point: 74 °C
• PSA: 38.05000
• LogP: 1.55000
• Storage Temp.: 2-8°C
• Water Solubility.: Slightly soluble in water.
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 144.0221037
• Heavy Atom Count: 7
• Complexity: 31.9

Purity/Quality:

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

Azetidin-3-aminedihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(CN1)N.Cl.Cl
• Uses: 3-Aminoazetidine dihydrochloride, is used as active pharmaceutical intermediates.

Technology Process of Azetidin-3-amine dihydrochloride

There total 2 articles about 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-Azido-1-benzhydryl-azetidine (143699-92-7) → azetidin-3-amine dihydrogen chloride (102065-89-4)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal; In methanol;

DOI:10.1248/cpb.41.126

Reference yield:

→ azetidin-3-amine dihydrogen chloride (102065-89-4)

Guidance literature:

Reference yield: 91.0%

azetidin-3-amine dihydrogen chloride (102065-89-4) + 1-(5-amino-2,4-difluorophenyl)-7-chloro-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid (179739-41-4) → 7-(3-aminoazetidin-1-yl)-1-(3-amino-4,6-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid

Guidance literature:

With triethylamine; In acetonitrile; at 80 ℃; for 15h;

DOI:10.1021/jm0205090

upstream raw materials:

3-Azido-1-benzhydryl-azetidine

Downstream raw materials:

(2S,4S)-2-(3-aminoazetidin-1-ylcarbonyl]-4-(4-methoxybenzylthio)-1-methylpyrrolidine

(2S,4S)-2-(3-aminoazetidin-1-ylcarbonyl)-4-(4-methoxybenzylthio)-1-(4-nitrobenzyloxycarbonyl)pyrrolidine

Refernces

• 1、 -. "3-aminoazetidine, its salts and intermediates of synthesis". . . Retrieved 2008/06/13.