tert-Butyl (5-cyanonaphthalen-2-yl)carbamate

Base Information

• Chemical Name: tert-Butyl (5-cyanonaphthalen-2-yl)carbamate
• CAS No.: 685902-47-0
• Molecular Formula: C₁₆H₁₆N₂O₂
• Molecular Weight: 268.315
• DSSTox Substance ID: DTXSID40700557
• Wikidata: Q82631959
• Mol file: 685902-47-0.mol

Synonyms:685902-47-0;tert-butyl 5-cyanonaphthalen-2-ylcarbamate;tert-Butyl (5-cyanonaphthalen-2-yl)carbamate;SCHEMBL14503720;DTXSID40700557;TERT-BUTYL N-(5-CYANONAPHTHALEN-2-YL)CARBAMATE

Chemical Property of tert-Butyl (5-cyanonaphthalen-2-yl)carbamate

Chemical Property:

• PSA: 62.12000
• LogP: 4.13148
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 268.121177757
• Heavy Atom Count: 20
• Complexity: 404

Purity/Quality:

97% ^*data from raw suppliers

TERT-BUTYL-(5-CYANO-2-NAPHTHYL)CARBAMATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC1=CC2=C(C=C1)C(=CC=C2)C#N

Technology Process of tert-Butyl (5-cyanonaphthalen-2-yl)carbamate

There total 4 articles about tert-Butyl (5-cyanonaphthalen-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:

5-bromo-2-naphthalenecarboxylic acid methyl ester (67878-76-6) → (5-cyanonaphthalen-2-yl)carbamic acid tert-butyl ester (685902-47-0)

Guidance literature:

Multi-step reaction with 3 steps

1: pyridine / dimethylformamide / 6 h / 160 °C

2: aq. NaOH / methanol / 20 °C

3: 4.2 g / Et₃N; phosphorazidic acid diphenyl ester / 72 h

With pyridine; sodium hydroxide; diphenyl phosphoryl azide; triethylamine; In methanol; N,N-dimethyl-formamide;

DOI:10.1021/jm030540h

Reference yield:

5-bromonaphthalene-2-carboxylic acid (1013-83-8) → (5-cyanonaphthalen-2-yl)carbamic acid tert-butyl ester (685902-47-0)

Guidance literature:

Multi-step reaction with 4 steps

1: 3.82 g / HCl(g) / 5 h / Heating

2: pyridine / dimethylformamide / 6 h / 160 °C

3: aq. NaOH / methanol / 20 °C

4: 4.2 g / Et₃N; phosphorazidic acid diphenyl ester / 72 h

With pyridine; hydrogenchloride; sodium hydroxide; diphenyl phosphoryl azide; triethylamine; In methanol; N,N-dimethyl-formamide;

DOI:10.1021/jm030540h

Reference yield:

5-cyanonaphthalene-2-carboxylic acid methyl ester (91804-23-8) → (5-cyanonaphthalen-2-yl)carbamic acid tert-butyl ester (685902-47-0)

Guidance literature:

Multi-step reaction with 2 steps

1: aq. NaOH / methanol / 20 °C

2: 4.2 g / Et₃N; phosphorazidic acid diphenyl ester / 72 h

With sodium hydroxide; diphenyl phosphoryl azide; triethylamine; In methanol;

DOI:10.1021/jm030540h

upstream raw materials:

5-cyano-naphthalene-2-carboxylic acid

tert-butyl alcohol

5-bromo-2-naphthalenecarboxylic acid methyl ester

5-bromonaphthalene-2-carboxylic acid

Downstream raw materials:

{5-[2-(3-trifluoromethyl-phenyl)-vinyl]-naphthalen-2-yl}-carbamic acid tert-butyl ester

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 685902-47-0 TERT-BUTYL (5-CYANO-2-NAPHTHYL)CARBAMATE

Send

Send

Metric Ton KG G Pound L ML

Send

Send