Benzyl N-(5-aminopentyl)carbamate

Base Information

• Chemical Name: Benzyl N-(5-aminopentyl)carbamate
• CAS No.: 69747-36-0
• Molecular Formula: C13H20 N2 O2
• Molecular Weight: 236.314
• European Community (EC) Number: 620-995-0,829-952-2
• Nikkaji Number: J1.405.003E
• Mol file: 69747-36-0.mol

Synonyms:benzyl 5-aminopentylcarbamate;69747-36-0;Benzyl N-(5-aminopentyl)carbamate;N-Cbz-1,5-diaminopentane;N-Carbobenzoxy-1,5-diaminopentane Hydrochloride;Carbamic acid, (5-aminopentyl)-, phenylmethyl ester;SCHEMBL2076614;BenzylN-(5-aminopentyl)carbamate;ZZRXQSABHQZWCC-UHFFFAOYSA-N;5-(benzyloxycarbonylamino)pentanamine;AKOS030214645;N-benzyloxycarbonyl-1,5-diamino-pentane;N-(Benzyloxycarbonyl)-1,5-pentanediamine;(5-amino-pentyl)-carbamic acid-benzyl ester;FT-0764715;EN300-208914

Chemical Property of Benzyl N-(5-aminopentyl)carbamate

Chemical Property:

• Melting Point: 172-175 °C
• PSA: 64.35000
• LogP: 3.13300
• Storage Temp.: 2-8°C
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 236.152477885
• Heavy Atom Count: 17
• Complexity: 204

Purity/Quality:

98%min ^*data from raw suppliers

N-CBZ-1,5-DIAMINOPENTANE 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC(=O)NCCCCCN

Technology Process of Benzyl N-(5-aminopentyl)carbamate

There total 14 articles about Benzyl N-(5-aminopentyl)carbamate 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: 99.0%

1-azidopentane-5-(N-benzyloxycarbonyl)amine (315203-49-7) → (5-aminopentyl)carbamic acid benzyl ester (69747-36-0)

Guidance literature:

With hydrogen; palladium on activated charcoal; ethylenediamine; In tetrahydrofuran; at 20 ℃; for 2h; under 760 Torr;

DOI:10.1016/S0040-4020(00)00771-7

Reference yield: 72.0%

(S)-1-cyano-N--N'--1,5-diaminopentane (175660-26-1) → (5-aminopentyl)carbamic acid benzyl ester (69747-36-0)

Guidance literature:

With ammonia; hydrogen; nickel; In methanol; at 50 ℃; for 72h; under 5168.35 Torr;

DOI:10.1021/ja0018670

Reference yield: 60.0%

1,5-diaminopentane (462-94-2) + benzyl chloroformate (501-53-1,94274-21-2) → (5-aminopentyl)carbamic acid benzyl ester (69747-36-0)

Guidance literature:

In dichloromethane; at 5 ℃; for 12h;

DOI:10.1016/j.bmc.2016.09.059

upstream raw materials:

N,N'-pentane-1,5-diyl-bis-carbamic acid dibenzyl ester

1,5-diaminopentane

benzyl chloroformate

1-azidopentane-5-(N-benzyloxycarbonyl)amine

Downstream raw materials:

{5-[4-(5-Benzyloxycarbonylamino-pentylcarbamoyl)-butyrylamino]-pentyl}-carbamic acid benzyl ester

[5-(5-Bromo-2-chloro-pyrimidin-4-ylamino)-pentyl]-carbamic acid-benzyl ester

C₃₆H₅₀N₄O₆

FmocGlu(OtBu)NH(CH₂)5NHZ

Refernces

• 1、 Arnatt, Christopher K.,Falls, Bethany A.,Yuan, Yunyun,Raborg, Thomas J.,Masvekar, Ruturaj R.,El-Hage, Nazira,Selley, Dana E.,Nicola, Anthony V.,Knapp, Pamela E.,Hauser, Kurt F.,Zhang, Yan. "Exploration of bivalent ligands targeting putative mu opioid receptor and chemokine receptor CCR5 dimerization". . p. 5969 - 5987. Retrieved 2016/11/09.
• 2、 Middleton, Richard J.,Briddon, Stephen J.,Cordeaux, Yolande,Yates, Andrew S.,Dale, Clare L.,George, Michael W.,Baker, Julian G.,Hill, Stephen J.,Kellam, Barrie. "New fluorescent adenosine A1-receptor agonists that allow quantification of ligand-receptor interactions in microdomains of single living cells". . p. 782 - 793. Retrieved 2008/01/27.