1,3-Benzenediamine, 4,6-dinitro-N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-

Base Information

Chemical Name:1,3-Benzenediamine, 4,6-dinitro-N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-
CAS No.:142744-17-0
Molecular Formula:C16H21 N5 O5 S
Molecular Weight:395.43
Hs Code.:
DSSTox Substance ID:DTXSID40162156
Nikkaji Number:J491.780D
Wikidata:Q83030725
Pharos Ligand ID:FG3Q39KZJ9LM
ChEMBL ID:CHEMBL107892
Mol file:142744-17-0.mol

Synonyms:142744-17-0;BRN 5836042;1,3-Benzenediamine, 4,6-dinitro-N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-;CHEMBL107892;1,3-Benzenediamine, 4,6-dinitro-N-(2-(((5-((dimethylamino)methyl)-2-fu ranyl)methyl)thio)ethyl)-;3-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitrobenzene-1,3-diamine;C16H21N5O5S;DTXSID40162156;HAFSYIUXFNUVMN-UHFFFAOYSA-N;BDBM50004664;C16-H21-N5-O5-S;LS-29607;N-[2-(5-Dimethylaminomethyl-furan-2-ylmethylsulfanyl)-ethyl]-4,6-dinitro-benzene-1,3-diamine;N-[2-[[[5-[(Dimethylamino)methyl]-2-furanyl]methyl]thio]ethyl]-2,4-dinitrobenzene-1,5-diamine

Suppliers and Price of 1,3-Benzenediamine, 4,6-dinitro-N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-

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

American Custom Chemicals Corporation
1,3-BENZENEDIAMINE, 4,6-DINITRO-N-(2-(((5-((DIMETHYLAMINO)METHYL)-2-FU RANYL)METHYL)THIO)ETHYL)- 95.00%
5MG
$ 505.24

Total 2 raw suppliers

Chemical Property of 1,3-Benzenediamine, 4,6-dinitro-N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-

Chemical Property:

Vapor Pressure:1.29E-14mmHg at 25°C
Boiling Point:605.6°Cat760mmHg
Flash Point:320.1°C
PSA：171.37000
Density:1.402g/cm³
LogP:4.78570
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:395.12633996
Heavy Atom Count:27
Complexity:501

Purity/Quality:

99% ^*data from raw suppliers

1,3-BENZENEDIAMINE, 4,6-DINITRO-N-(2-(((5-((DIMETHYLAMINO)METHYL)-2-FU RANYL)METHYL)THIO)ETHYL)- 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C(=C2)N)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 1,3-Benzenediamine, 4,6-dinitro-N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-

There total 3 articles about 1,3-Benzenediamine, 4,6-dinitro-N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)- 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: 95.0%

: 142744-14-7
N-<2-<<<5-<(dimethylamino)methyl>-2-furanyl>methyl>thio>ethyl>-2,4-dinitro-5-fluoroaniline

: 142744-17-0
N-[2-(5-Dimethylaminomethyl-furan-2-ylmethylsulfanyl)-ethyl]-4,6-dinitro-benzene-1,3-diamine

Guidance literature:: With ammonia; sodium carbonate; In acetonitrile; Heating;
DOI:10.1021/jm00095a008

Reference yield:

: 327-92-4
1,5-difluoro-2,4-dinitrobenzene

: 142744-17-0
N-[2-(5-Dimethylaminomethyl-furan-2-ylmethylsulfanyl)-ethyl]-4,6-dinitro-benzene-1,3-diamine

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / Na₂CO₃ / acetonitrile / Ambient temperature

2: 95 percent / ammonia, Na₂CO₃ / acetonitrile / Heating

With ammonia; sodium carbonate; In acetonitrile;
DOI:10.1021/jm00095a008

Reference yield:

: 66356-53-4
5-{[(2-aminoethyl)thio]methyl}-N,N-dimethyl-2-furfurylamine

: 142744-17-0
N-[2-(5-Dimethylaminomethyl-furan-2-ylmethylsulfanyl)-ethyl]-4,6-dinitro-benzene-1,3-diamine

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / Na₂CO₃ / acetonitrile / Ambient temperature

2: 95 percent / ammonia, Na₂CO₃ / acetonitrile / Heating

With ammonia; sodium carbonate; In acetonitrile;
DOI:10.1021/jm00095a008