6-(4-Nitrophenyl)-1,3,5-triazine-2,4-diamine

Base Information

Chemical Name:6-(4-Nitrophenyl)-1,3,5-triazine-2,4-diamine
CAS No.:29366-73-2
Molecular Formula:C9H8 N6 O2
Molecular Weight:232.202
Hs Code.:2933699090
NSC Number:121174
DSSTox Substance ID:DTXSID90298151
Nikkaji Number:J104.344G
Wikidata:Q82039787
ChEMBL ID:CHEMBL139846
Mol file:29366-73-2.mol

Synonyms:6-(4-Nitrophenyl)-1,3,5-triazine-2,4-diamine;29366-73-2;1,3,5-Triazine-2,4-diamine, 6-(4-nitrophenyl)-;6-(4-Nitrophenyl)-1,3,5-triazine-2,4(1h,3h)-diimine;2,4-diamino-6-(4-nitrophenyl)-1,3,5-triazine;NSC121174;s-Triazine, 2,4-diamino-6-(p-nitrophenyl)-;Cambridge id 5253337;Oprea1_078222;CHEMBL139846;SCHEMBL9566556;DTXSID90298151;NMEQRRZUQAFVIV-UHFFFAOYSA-N;MFCD00436796;STK727869;AKOS000113392;NSC-121174;AS-67227;s-Triazine,4-diamino-6-(p-nitrophenyl)-;CS-0060212;FT-0744435;A18587;W18379;1,5-Triazine-2,4-diamine, 6-(4-nitrophenyl)-;SR-01000492269;6-(4-Nitrophenyl)-1,3,5-triazine-2,4-diamine #;SR-01000492269-1

Suppliers and Price of 6-(4-Nitrophenyl)-1,3,5-triazine-2,4-diamine

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
6-(4-NITROPHENYL)-1,3,5-TRIAZINE-2,4-DIAMINE 95.00%
5MG
$ 496.91

Total 10 raw suppliers

Chemical Property of 6-(4-Nitrophenyl)-1,3,5-triazine-2,4-diamine

Chemical Property:

Vapor Pressure:7.78E-14mmHg at 25°C
Melting Point:330-331 °C
Boiling Point:588.7°Cat760mmHg
PKA:3.85±0.10(Predicted)
Flash Point:309.8°C
PSA：136.53000
Density:1.539g/cm³
LogP:2.29680
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:232.07087352
Heavy Atom Count:17
Complexity:265

Purity/Quality:

99%, ^*data from raw suppliers

6-(4-NITROPHENYL)-1,3,5-TRIAZINE-2,4-DIAMINE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=NC(=NC(=N2)N)N)[N+](=O)[O-]

Technology Process of 6-(4-Nitrophenyl)-1,3,5-triazine-2,4-diamine

There total 4 articles about 6-(4-Nitrophenyl)-1,3,5-triazine-2,4-diamine 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%

: 127099-85-8,780722-26-1,461-58-5
N-Cyanoguanidine

: 619-72-7
4-nitrobenzonitrile

: 29366-73-2
2,4-diamino-6-(4-nitrophenyl)-1,3,5-triazine

Guidance literature:: With potassium hydroxide; In pentan-1-ol; at 140 ℃; for 24h;
DOI:10.1021/jo961877c

Reference yield: 72.0%

: 555-16-8
4-nitrobenzaldehdye

: 127099-85-8,780722-26-1,461-58-5
N-Cyanoguanidine

: 29366-73-2
2,4-diamino-6-(4-nitrophenyl)-1,3,5-triazine

Guidance literature:: 4-nitrobenzaldehdye; With ammonia; iodine; In tetrahydrofuran; water; at 20 ℃; for 1h;

N-Cyanoguanidine; With potassium hydroxide; In tetrahydrofuran; water; for 24h; Further stages.; Heating;
DOI:10.1021/jo026407z

Reference yield:

: 555-16-8
4-nitrobenzaldehdye

: 29366-73-2
2,4-diamino-6-(4-nitrophenyl)-1,3,5-triazine

Guidance literature:: Multi-step reaction with 2 steps

1: aq. NH₃; iodine / tetrahydrofuran / 1 h / 25 °C

2: tetrahydrofuran; H₂O / 80 °C / microwave irradiation

With ammonium hydroxide; iodine; In tetrahydrofuran; water;
DOI:10.1021/jo0625352