4-(Azidomethyl)phenol

Base Information

• Chemical Name: 4-(Azidomethyl)phenol
• CAS No.: 55116-31-9
• Molecular Formula: C7H7N3O
• Molecular Weight: 149.152
• DSSTox Substance ID: DTXSID50449521
• Nikkaji Number: J993.587H
• Wikidata: Q82269025

Synonyms:4-(azidomethyl)phenol;55116-31-9;Phenol, 4-(azidomethyl)-;SCHEMBL13627733;DTXSID50449521;AKOS018662119;EN300-279328

Chemical Property of 4-(Azidomethyl)phenol

Chemical Property:

• PSA: 69.98000
• LogP: 1.65526
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 149.058911855
• Heavy Atom Count: 11
• Complexity: 157

Purity/Quality:

99%, ^*data from raw suppliers

4-(Azidomethyl)phenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1CN=[N+]=[N-])O

Technology Process of 4-(Azidomethyl)phenol

There total 5 articles about 4-(Azidomethyl)phenol 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: 94.0%

(4-hydroxyphenyl)methanol (623-05-2) → 1-(azidomethyl)-4-hydroxybenzene (55116-31-9)

Guidance literature:

With sodium azide; triphenylphosphine; In dichloromethane; N,N-dimethyl-formamide; at 90 ℃; for 1h;

DOI:10.1080/00397910008087402

Reference yield: 88.0%

4-hydroxybenzyl acetate (80767-12-0) → 1-(azidomethyl)-4-hydroxybenzene (55116-31-9)

Guidance literature:

With sodium azide; In methanol; for 1.5h; Heating;

DOI:10.1016/S0040-4039(00)99619-9

Reference yield:

4-(bromomethyl)phenol (27079-92-1) → 1-(azidomethyl)-4-hydroxybenzene (55116-31-9)

Guidance literature:

With sodium azide; In N,N-dimethyl-formamide; at 20 ℃; for 4h;

DOI:10.1021/ja711125p

upstream raw materials:

4-hydroxybenzyl acetate

(4-hydroxyphenyl)methanol

4-(bromomethyl)phenol

phenol

Downstream raw materials:

C₁₆H₁₅N₃O₂

C₁₆H₁₅N₃O₂

4-(azidomethyl)phenyl ethenesulfonate

1-(2-((1-(4-hydroxybenzyl)-1H-1,2,3-triazol-4-yl)methylamino)-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl)-3-tert-butylurea

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