benzyl N-(4-nitrophenyl)carbamate

Base Information

Chemical Name:benzyl N-(4-nitrophenyl)carbamate
CAS No.:53821-12-8
Molecular Formula:C14H12 N2 O4
Molecular Weight:272.26
Hs Code.:
NSC Number:171077
DSSTox Substance ID:DTXSID90305556
Wikidata:Q82052218
Mol file:53821-12-8.mol

Synonyms:benzyl N-(4-nitrophenyl)carbamate;53821-12-8;NSC171077;SCHEMBL87044;benzyl (4-nitrophenyl)carbamate;Benzyl 4-nitrophenylcarbamate #;benzylN-(4-nitrophenyl)carbamate;DTXSID90305556;CCBJUOVCMNSVPT-UHFFFAOYSA-N;AKOS003446166;Aniline, N-benzyloxycarbonyl-4-nitro-;NSC-171077;BS-28885;F70393;EN300-7345183;SR-01000507691;Carbamic acid, (4-nitrophenyl)-, phenylmethyl ester;SR-01000507691-1

Suppliers and Price of benzyl N-(4-nitrophenyl)carbamate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
BenzylN-(4-nitrophenyl)carbamate
1g
$ 200.00

Crysdot
BenzylN-(4-nitrophenyl)carbamate 95+%
5g
$ 339.00

American Custom Chemicals Corporation
(4-NITROPHENYL)-CARBAMIC ACID PHENYLMETHYL ESTER 95.00%
5MG
$ 502.55

Total 6 raw suppliers

Chemical Property of benzyl N-(4-nitrophenyl)carbamate

Chemical Property:

Vapor Pressure:1.07E-06mmHg at 25°C
Melting Point:155 °C
Boiling Point:402.8°Cat760mmHg
PKA:12.59±0.70(Predicted)
Flash Point:197.4°C
PSA：84.15000
Density:1.351g/cm³
LogP:3.93970
Storage Temp.:-20°C Freezer, Under inert atmosphere
Solubility.:Chloroform (Sparingly), DMSO (Slightly)
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:272.07970687
Heavy Atom Count:20
Complexity:329

Purity/Quality:

99% ^*data from raw suppliers

BenzylN-(4-nitrophenyl)carbamate ^*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=C(C=C2)[N+](=O)[O-]

Technology Process of benzyl N-(4-nitrophenyl)carbamate

There total 12 articles about benzyl N-(4-nitrophenyl)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: 91.8%

: 100-01-6,104810-17-5
4-nitro-aniline

: 501-53-1,94274-21-2
benzyl chloroformate

: 53821-12-8
benzyl 4-(nitro)phenylcarbamate

Guidance literature:: In PEG-600; at 20 ℃; for 0.166667h; chemoselective reaction;
DOI:10.1016/j.cclet.2012.05.012

Reference yield: 87.0%

: 124-38-9,18923-20-1
carbon dioxide

: 100-44-7
benzyl chloride

: 100-01-6,104810-17-5
4-nitro-aniline

: 53821-12-8
benzyl 4-(nitro)phenylcarbamate

Guidance literature:: carbon dioxide; 4-nitro-aniline; With tetra-(n-butyl)ammonium iodide; caesium carbonate; In N,N-dimethyl-formamide; at 23 ℃; for 1h;

benzyl chloride; In N,N-dimethyl-formamide; at 23 ℃; for 120h;
DOI:10.1016/S0040-4020(02)00286-7