Benzyl (6-aminopyridin-2-yl)carbamate

Base Information

• Chemical Name: Benzyl (6-aminopyridin-2-yl)carbamate
• CAS No.: 853058-07-8
• Molecular Formula: C13H13N3O2
• Molecular Weight: 243.265
• DSSTox Substance ID: DTXSID10697384
• Wikidata: Q82627271
• Mol file: 853058-07-8.mol

Synonyms:853058-07-8;Benzyl (6-aminopyridin-2-yl)carbamate;benzyl N-(6-aminopyridin-2-yl)carbamate;DTXSID10697384;benzyl 6-aminopyridin-2-ylcarbamate;N-(6-AMINO-2-PYRIDINYL)-CARBAMIC ACID PHENYLMETHYL ESTER;carbamic acid,n-(6-amino-2-pyridinyl)-,phenylmethyl ester;CARBAMIC ACID, N-(6-AMINO-2-PYRIDINYL)-,PHENYLMETHYL ESTER

Chemical Property of Benzyl (6-aminopyridin-2-yl)carbamate

Chemical Property:

• PSA: 81.46000
• LogP: 2.35620
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 243.100776666
• Heavy Atom Count: 18
• Complexity: 267

Purity/Quality:

97% ^*data from raw suppliers

Carbamicacid,N-(6-amino-2-pyridinyl)-,phenylmethylester 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC(=O)NC2=CC=CC(=N2)N

Technology Process of Benzyl (6-aminopyridin-2-yl)carbamate

There total 1 articles about Benzyl (6-aminopyridin-2-yl)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: 84.0%

2.6-diaminopyridine (141-86-6) + benzyl chloroformate (501-53-1,94274-21-2) → benzyl (6-aminopyridin-2-yl)carbamate (853058-07-8)

Guidance literature:

2.6-diaminopyridine; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 1h;

benzyl chloroformate; In tetrahydrofuran; hexane; at 20 ℃; for 2h;

DOI:10.1002/ejoc.200400641

Reference yield: 98.0%

benzyl (6-aminopyridin-2-yl)carbamate (853058-07-8) + 4-decyloxy-2,6-pyridinedicarboxylic acid monomethyl ester (796885-02-4) → 6-(6-benzyloxycarbonylamino-pyridin-2-ylcarbamoyl)-4-decyloxy-pyridine-2-carboxylic acid methyl ester (853058-08-9)

Guidance literature:

4-decyloxy-2,6-pyridinedicarboxylic acid monomethyl ester; With thionyl chloride; Heating;

benzyl (6-aminopyridin-2-yl)carbamate; With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 12h;

DOI:10.1002/ejoc.200400641

Reference yield: 82.0%

benzyl (6-aminopyridin-2-yl)carbamate (853058-07-8) + isobutyryl chloride (79-30-1) → benzyl (6-isobutyramidopyridin-2-yl)carbamate

Guidance literature:

With pyridine; at 20 ℃; for 2h;

upstream raw materials:

2.6-diaminopyridine

benzyl chloroformate

Downstream raw materials:

6-(6-benzyloxycarbonylamino-pyridin-2-ylcarbamoyl)-4-decyloxy-pyridine-2-carboxylic acid methyl ester

6-(6-benzyloxycarbonylamino-pyridin-2-ylcarbamoyl)-4-decyloxy-pyridine-2-carboxylic acid

6-(6-{[6-(6-benzyloxycarbonylamino-pyridin-2-ylcarbamoyl)-4-decyloxy-pyridine-2-carbonyl]-amino}-pyridin-2-ylcarbamoyl)-4-decyloxy-pyridine-2-carboxylic acid methyl ester

6-(6-{[6-(6-benzyloxycarbonylamino-pyridin-2-ylcarbamoyl)-4-decyloxy-pyridine-2-carbonyl]-amino}-pyridin-2-ylcarbamoyl)-4-decyloxy-pyridine-2-carboxylic acid

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