(1-Aminomethyl-cyclopentyl)-carbamic acid tert-butyl ester

Base Information

• Chemical Name: (1-Aminomethyl-cyclopentyl)-carbamic acid tert-butyl ester
• CAS No.: 889949-09-1
• Molecular Formula: C₁₁H₂₂N₂O₂
• Molecular Weight: 214.308
• Hs Code.: 2924299090
• European Community (EC) Number: 804-295-4
• DSSTox Substance ID: DTXSID50587694
• Wikidata: Q82480194
• Mol file: 889949-09-1.mol

Synonyms:889949-09-1;(1-Aminomethyl-cyclopentyl)-carbamic acid tert-butyl ester;tert-butyl N-[1-(aminomethyl)cyclopentyl]carbamate;tert-butyl (1-(aminomethyl)cyclopentyl)carbamate;1-(Boc-amino)-1-aminomethyl cyclopentane;tert-butyl 1-(aminomethyl)cyclopentylcarbamate;MFCD06660470;tert-Butyl [1-(aminomethyl)cyclopentyl]carbamate;SCHEMBL1134597;DTXSID50587694;XEJPADMAPZAZEL-UHFFFAOYSA-N;1-(Boc-amino)cyclopentylmethanamine;BBL101170;STL554966;AKOS005257188;MCULE-1112451341;AC-30513;AS-55032;CS-0036401;EN300-299753;tert-butyl(1-(aminomethyl)cyclopentyl)carbamate;W12524;1-(Boc-amino)-1-aminomethyl cyclopentane, 95%;(1-Aminomethylcyclopentyl)-carbamic acid tert-butyl ester

Chemical Property of (1-Aminomethyl-cyclopentyl)-carbamic acid tert-butyl ester

Chemical Property:

• Vapor Pressure: 0.000327mmHg at 25°C
• Melting Point: 72-78 °C
• Refractive Index: 1.491
• Boiling Point: 320°C at 760 mmHg
• PKA: 12.62±0.20(Predicted)
• Flash Point: 147.3°C
• PSA: 64.35000
• Density: 1.03g/cm³
• LogP: 2.87380
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 214.168127949
• Heavy Atom Count: 15
• Complexity: 227

Purity/Quality:

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

tert-butylN-[1-(aminomethyl)cyclopentyl]carbamate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC1(CCCC1)CN

Technology Process of (1-Aminomethyl-cyclopentyl)-carbamic acid tert-butyl ester

There total 2 articles about (1-Aminomethyl-cyclopentyl)-carbamic acid tert-butyl ester 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:

(1-cyanocyclopentyl)-carbamic acid tert-butyl ester (912770-99-1) → (1-aminomethylcyclopentyl)carbamic acid tert-butyl ester (889949-09-1) + 1-(aminomethyl)cyclopentanamine (5062-66-8)

Guidance literature:

In tetrahydrofuran;

Reference yield:

(1-cyanocyclopentyl)-carbamic acid tert-butyl ester (912770-99-1) → (1-aminomethylcyclopentyl)carbamic acid tert-butyl ester (889949-09-1)

Guidance literature:

(1-cyanocyclopentyl)-carbamic acid tert-butyl ester; With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20 ℃; Inert atmosphere;

With water; sodium hydroxide; In tetrahydrofuran;

Reference yield:

(1-aminomethylcyclopentyl)carbamic acid tert-butyl ester (889949-09-1) → 1-(aminomethyl)cyclopentanamine (5062-66-8)

Guidance literature:

(1-aminomethylcyclopentyl)carbamic acid tert-butyl ester; With trimethylsilyl iodide; In DCM;

With methanol; In dichloromethane;

upstream raw materials:

(1-cyanocyclopentyl)-carbamic acid tert-butyl ester

Downstream raw materials:

1-(aminomethyl)cyclopentanamine

Refernces

• 1、 -. "COMPOSITIONS FOR TREATMENT OF CYSTIC FIBROSIS AND OTHER CHRONIC DISEASES". . . Retrieved 2012/04/23.