Phenyl N-(4-bromophenyl)carbamate

Base Information

• Chemical Name: Phenyl N-(4-bromophenyl)carbamate
• CAS No.: 50882-29-6
• Molecular Formula: C13H10BrNO2
• Molecular Weight: 292.132
• Hs Code.: 2924299090
• European Community (EC) Number: 667-377-7
• DSSTox Substance ID: DTXSID20398759
• Wikidata: Q82200909
• Mol file: 50882-29-6.mol

Synonyms:Phenyl N-(4-bromophenyl)carbamate;50882-29-6;Phenyl (4-bromophenyl)carbamate;phenyl 4-bromophenylcarbamate;Phenyl(4-bromophenyl)carbamate;SCHEMBL11173671;DTXSID20398759;MFCD00017806;AKOS000210253;AS-61488;CS-0037120;W12844

Chemical Property of Phenyl N-(4-bromophenyl)carbamate

Chemical Property:

• Melting Point: 154 °C
• Boiling Point: 359.6±34.0 °C(Predicted)
• PKA: 12.15±0.70(Predicted)
• PSA: 38.33000
• Density: 1.532±0.06 g/cm3(Predicted)
• LogP: 4.13300
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 290.98949
• Heavy Atom Count: 17
• Complexity: 246

Purity/Quality:

99% ^*data from raw suppliers

PHENYL N-(4-BROMOPHENYL)CARBAMATE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OC(=O)NC2=CC=C(C=C2)Br

Technology Process of Phenyl N-(4-bromophenyl)carbamate

There total 3 articles about Phenyl N-(4-bromophenyl)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: 97.0%

phenyl chloroformate (1885-14-9) + 4-bromo-aniline (106-40-1) → (4-bromophenyl)carbamic acid phenyl ester (50882-29-6)

Guidance literature:

In ethyl acetate; at 0 - 20 ℃; for 2h;

Reference yield: 59.1%

→ (4-bromophenyl)carbamic acid phenyl ester (50882-29-6)

Guidance literature:

With potassium carbonate; In dichloromethane; at 0 - 20 ℃; for 3.25h;

Reference yield:

p-bromobenzoyl azide (14917-59-0) + phenol (108-95-2,27073-41-2) → (4-bromophenyl)carbamic acid phenyl ester (50882-29-6)

Guidance literature:

With Petroleum ether;

upstream raw materials:

p-bromobenzoyl azide

phenol

phenyl chloroformate

4-bromo-aniline

Downstream raw materials:

(E)-1-{[(7-dimethylamino)-2-oxo-2H-chromen-3-yl]methylidene}-4-(4-bromophenyl)semicarbazone

1-(2-hydroxyethyl)-1-(3-methoxybenzyl)-3-[4-(1H-pyrazol-4-yl)phenyl]urea

3-(4-bromophenyl)-1-(2-hydroxyethyl)-1-(3-methoxybenzyl)urea

4-(4-bromophenyl)semicarbazide