Phenyl isocyanatoformate

Base Information Edit

Chemical Name:Phenyl isocyanatoformate
CAS No.:5843-43-6
Molecular Formula:C8H5NO3
Molecular Weight:163.133
Hs Code.:2929109000
European Community (EC) Number:625-578-7
DSSTox Substance ID:DTXSID70399918
Nikkaji Number:J81.099A
Mol file:5843-43-6.mol

Synonyms:Phenyl isocyanatoformate;5843-43-6;Phenyl N-(oxomethylidene)carbamate;phenoxycarbonyl isocyanate;Carbonisocyanatidic acid, phenyl ester;phenoxycarbonylisocyanate;Phenyl isocyanatoformate, 97%;SCHEMBL1124801;PHENYL N-CARBONYLCARBAMATE;DTXSID70399918;FSZKLYCUEQGCKW-UHFFFAOYSA-N;MFCD00037080;SY014832;F86547

Suppliers and Price of Phenyl isocyanatoformate

Supply Marketing:Edit

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

Sigma-Aldrich
Phenyl isocyanatoformate 97%
2g
$ 366.00

American Custom Chemicals Corporation
PHENYL ISOCYANATOFORMATE 95.00%
2G
$ 996.77

Total 5 raw suppliers

Chemical Property of Phenyl isocyanatoformate Edit

Chemical Property:

Vapor Pressure:0.0388mmHg at 25°C
Refractive Index:n20/D 1.516(lit.)
Boiling Point:100 °C15 mm Hg(lit.)
Flash Point:210 °F
PSA：55.73000
Density:1.233 g/mL at 25 °C(lit.)
LogP:1.52120
Storage Temp.:?20°C
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:163.026943022
Heavy Atom Count:12
Complexity:202

Purity/Quality:

98%,99%, ^*data from raw suppliers

Phenyl isocyanatoformate 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 20/21/22-36/37/38
Safety Statements: 23-26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC=C(C=C1)OC(=O)N=C=O
Uses Phenyl isocyanatoformate may be used in the synthesis of 8-(β-D-2′-deoxy-3′,5′-bis(4-toluoyloxy)ribofuranosyl)-imidazo[1,2-a]-1,3,5-triazine-2(8H),4(3H)-dione and 1,3,5-benzotriazepine-2,4-diones.

Technology Process of Phenyl isocyanatoformate

There total 4 articles about Phenyl isocyanatoformate 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: 59.0%