N-Benzyl-3-hydroxy-benzamide

Base Information

• Chemical Name: N-Benzyl-3-hydroxy-benzamide
• CAS No.: 15789-02-3
• Molecular Formula: C14H13 N O2
• Molecular Weight: 227.263
• Hs Code.: 2924299090
• European Community (EC) Number: 844-506-7
• DSSTox Substance ID: DTXSID90368469
• Wikidata: Q82155025
• Mol file: 15789-02-3.mol

Synonyms:N-Benzyl-3-hydroxy-benzamide;N-benzyl-3-hydroxybenzamide;15789-02-3;SCHEMBL3191663;DTXSID90368469;CMTKGWDQXAODLW-UHFFFAOYSA-N;3-Hydroxy-N-(phenylmethyl)benzamide;AKOS008928281;N-benzyl-3-hydroxy-benzamide, AldrichCPR;CS-0307758;EN300-06502;Z31478220

Chemical Property of N-Benzyl-3-hydroxy-benzamide

Chemical Property:

• Vapor Pressure: 9.7E-09mmHg at 25°C
• Boiling Point: 450.7°Cat760mmHg
• Flash Point: 226.4°C
• PSA: 52.82000
• Density: 1.202g/cm³
• LogP: 2.89700
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 227.094628657
• Heavy Atom Count: 17
• Complexity: 249

Purity/Quality:

98%Min ^*data from raw suppliers

N-Benzyl-3-hydroxy-benzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)O

Technology Process of N-Benzyl-3-hydroxy-benzamide

There total 7 articles about N-Benzyl-3-hydroxy-benzamide 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: 89.0%

3-Carboxyphenol (99-06-9) + benzylamine (100-46-9) → N-benzyl-3-hydroxybenzamide (15789-02-3)

Guidance literature:

In xylene; for 7.5h; Heating;

DOI:10.1021/je00030a035

Reference yield: 55.0%

N-benzyl-3-methoxybenzamide (82082-48-2) → N-benzyl-3-hydroxybenzamide (15789-02-3)

Guidance literature:

With trifluorormethanesulfonic acid; In toluene; at 150 ℃; for 0.25h; Microwave irradiation;

DOI:10.1016/j.tetlet.2010.07.022

Reference yield:

methyl 3-hydroxybenzoate (19438-10-9) + benzylamine (100-46-9) → N-benzyl-3-hydroxybenzamide (15789-02-3)

Guidance literature:

With ammonium chloride;

DOI:10.1021/jo01190a008

upstream raw materials:

methyl 3-hydroxybenzoate

benzylamine

ethyl-3-hydroxybenzoate

3-(chlorocarbonyl)phenyl acetate

Downstream raw materials:

N-Methyl-3-(3,4-dimethylphenoxy)-benzamid

4-(3-Benzylcarbamoyl-2,4,6-triiodo-phenoxy)-butyric acid

2-(3-Benzylcarbamoyl-2,4,6-triiodo-phenoxy)-butyric acid

N-Benzyl-3-hydroxy-2,4,6-triiodo-benzamide