benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate

Base Information

Chemical Name:benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate
CAS No.:207857-19-0
Molecular Formula:C18H16F3N3O6S
Molecular Weight:459.403
Hs Code.:
DSSTox Substance ID:DTXSID10399331
Nikkaji Number:J974.223I
Mol file:207857-19-0.mol

Synonyms:207857-19-0;N,N'-Dicarbobenzyloxy-N''-trifluoromethanesulfonylguanidine;benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate;1,3-Di-Z-2-(trifluoromethylsulfonyl)guanidine;2-(Trifluoromethylsulfonyl)-1,3-di-Z-guanidine;SCHEMBL2175288;DTXSID10399331;GLZHTZVKRCUQRB-UHFFFAOYSA-N;N,N'-diCbz-N''-triflylguanidine;N,N'-di-cbz-N''-triflylguanidine;1,3-Bis(benzyloxycarbonyl)-2-(trifluoromethylsulfonyl)guanidine;1 3-Di-z-2-(trifluoromethylsulfonyl)-;A912130;1,2-Bis(benzyloxycarbonyl)-3-(trifluoromethylsulfonyl)guanidine;1,3-Di-Z-2-(trifluoromethylsulfonyl)guanidine, >=98.0% (HPLC);N,N'-bis(benzyloxycarbonyl)-N''-trifluoromethanesulfonylguanidine

Suppliers and Price of benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]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

Sigma-Aldrich
1,3-Di-Z-2-(trifluoromethylsulfonyl)guanidine ≥98.0%(HPLC)
5 g
$ 955.00

Sigma-Aldrich
1,3-Di-Z-2-(trifluoromethylsulfonyl)guanidine ≥98.0% (HPLC)
5g-f
$ 745.00

Biosynth Carbosynth
1,3-Di-z-2-(trifluoromethylsulfonyl)guanidine
10 g
$ 700.00

Biosynth Carbosynth
1,3-Di-z-2-(trifluoromethylsulfonyl)guanidine
5 g
$ 500.00

Biosynth Carbosynth
1,3-Di-z-2-(trifluoromethylsulfonyl)guanidine
2 g
$ 300.00

Biosynth Carbosynth
1,3-Di-z-2-(trifluoromethylsulfonyl)guanidine
1 g
$ 200.00

Biosynth Carbosynth
1,3-Di-z-2-(trifluoromethylsulfonyl)guanidine
25 g
$ 1125.00

American Custom Chemicals Corporation
1,3-DI-Z-2-(TRIFLUOROMETHYLSULFONYL)GUANIDINE 95.00%
5G
$ 1535.34

American Custom Chemicals Corporation
1,3-DI-Z-2-(TRIFLUOROMETHYLSULFONYL)GUANIDINE 95.00%
0.25G
$ 374.00

Total 5 raw suppliers

Chemical Property of benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate

Chemical Property:

Melting Point:74-75 °C
PKA:-4.89±0.40(Predicted)
PSA：135.03000
Density:1.43g/cm³
LogP:4.72090
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:459.07119090
Heavy Atom Count:31
Complexity:702

Purity/Quality:

97% ^*data from raw suppliers

1,3-Di-Z-2-(trifluoromethylsulfonyl)guanidine ≥98.0%(HPLC) ^*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)NC(=NS(=O)(=O)C(F)(F)F)NC(=O)OCC2=CC=CC=C2

Technology Process of benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate

There total 5 articles about benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]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: 96.0%

: 10065-79-9
N,N’-bis(benzyloxycarbonyl)guanidine

: 207857-19-0
N,N'-bis(benzyloxycarbonyl)-N''-trifluoromethane-sulfonylguanidine

Guidance literature:: N,N’-bis(benzyloxycarbonyl)guanidine; With sodium hydride; In chlorobenzene; at 0 ℃; for 1h; Inert atmosphere;

With trifluoromethylsulfonic anhydride; In chlorobenzene; at -45 - 20 ℃; for 16h; Inert atmosphere;
DOI:10.1021/acs.orglett.6b01324