cis-3-((Benzyloxy)methyl)cyclobutanamine

Base Information

• Chemical Name: cis-3-((Benzyloxy)methyl)cyclobutanamine
• CAS No.: 847416-94-8
• Molecular Formula: C12H17NO
• Molecular Weight: 191.273
• DSSTox Substance ID: DTXSID50693401
• Mol file: 847416-94-8.mol

Synonyms:cis-3-((Benzyloxy)methyl)cyclobutanamine;847416-94-8;3-(BENZYLOXYMETHYL)CYCLOBUTANAMINE;3-[(Benzyloxy)methyl]cyclobutan-1-amine;1824080-00-3;SCHEMBL5006985;SCHEMBL5006990;SCHEMBL14010327;DTXSID50693401;EN300-1587497;(1S,3S)-3-[(BENZYLOXY)METHYL]CYCLOBUTAN-1-AMINE

Chemical Property of cis-3-((Benzyloxy)methyl)cyclobutanamine

Chemical Property:

• Vapor Pressure: 0.004mmHg at 25°C
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 191.131014166
• Heavy Atom Count: 14
• Complexity: 160

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(CC1N)COCC2=CC=CC=C2

Technology Process of cis-3-((Benzyloxy)methyl)cyclobutanamine

There total 3 articles about cis-3-((Benzyloxy)methyl)cyclobutanamine 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:

C12H15N3O (847416-96-0) → {cis-3-[(benzyloxy)methyl]cyclobutyl}amine (847416-94-8)

Guidance literature:

With sodium tetrahydroborate; nickel dichloride; In ethanol; at 0 - 20 ℃; for 3h;

Reference yield:

C13H18O4S → {cis-3-[(benzyloxy)methyl]cyclobutyl}amine (847416-94-8)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium azide / N,N-dimethyl-formamide / 12 h / 95 °C

2: sodium tetrahydroborate / nickel dichloride / ethanol / 3 h / 0 - 20 °C

With sodium tetrahydroborate; sodium azide; nickel dichloride; In ethanol; N,N-dimethyl-formamide;

Reference yield:

(1r,3r)-3-((benzyloxy)methyl)cyclobutanol (172324-65-1) → {cis-3-[(benzyloxy)methyl]cyclobutyl}amine (847416-94-8)

Guidance literature:

Multi-step reaction with 3 steps

1: triethylamine / dichloromethane / 1.25 h / 0 °C

2: sodium azide / N,N-dimethyl-formamide / 12 h / 95 °C

3: sodium tetrahydroborate / nickel dichloride / ethanol / 3 h / 0 - 20 °C

With sodium tetrahydroborate; sodium azide; triethylamine; nickel dichloride; In ethanol; dichloromethane; N,N-dimethyl-formamide;

upstream raw materials:

C₁₂H₁₅N₃O

(1r,3r)-3-((benzyloxy)methyl)cyclobutanol

Downstream raw materials:

cis-3-amino-1-cyclobutanemethanol

benzyl [cis-3-(hydroxymethyl)cyclobutyl]carbamate