4,6-Diamino-2-(5-nitro-2-furyl)-s-triazine

Base Information

• Chemical Name: 4,6-Diamino-2-(5-nitro-2-furyl)-s-triazine
• CAS No.: 720-69-4
• Molecular Formula: C7H6 N6 O3
• Molecular Weight: 222.19
• NSC Number: 14430
• UNII: KB9HX6DT5Z
• DSSTox Substance ID: DTXSID7020396
• Wikidata: Q63088178
• ChEMBL ID: CHEMBL315614
• Mol file: 720-69-4.mol

Synonyms:720-69-4;4,6-Diamino-2-(5-nitro-2-furyl)-s-triazine;6-(5-nitrofuran-2-yl)-1,3,5-triazine-2,4-diamine;CCRIS 922;NSC 14430;s-Triazine, 2,4-diamino-6-(5-nitro-2-furyl)-;s-Triazine, 4,6-diamino-2-(5-nitro-2-furyl)-;BRN 0251037;4,6-Diamino-2-(5-nitro-2-furyl)-1,3,5-triazine;6-(5-Nitro-2-furanyl)-1,3,5-triazine-2,4-diamine;MLS002638377;1,3,5-Triazine-2,4-diamine, 6-(5-nitro-2-furanyl)-;NSC-14430;1,3,5-Triazine-2,4-diamine, 6-(5-nitro-2-furyl)-;WLN: T6N CN ENJ BZ DZ F- BT5OJ ENW;6-(5-nitro-2-furyl)-1,3,5-triazine-2,4-diamine;KB9HX6DT5Z;C7H6N6O3;CHEMBL315614;SCHEMBL3293364;DTXSID7020396;HMS3086J13;C7-H6-N6-O3;NSC14430;LS-7308;SMR001547863;s-Triazine,4-diamino-6-(5-nitro-2-furyl)-;s-Triazine,6-diamino-2-(5-nitro-2-furyl)-;4,6-diamino-2-(5-nitro-2-fur-yl)-s-triazine;EN300-10951367;1,5-Triazine-2,4-diamine, 6-(5-nitro-2-furanyl)-;Q63088178;S-TRIAZINE,4,6-DIAMINO-2-(5-NITRO-2-FURYL)-;NITRO-2-FURANYL)-1,3,5-TRIAZINE-2,4-DIAMINE, 6-(5-

Chemical Property of 4,6-Diamino-2-(5-nitro-2-furyl)-s-triazine

Chemical Property:

• Vapor Pressure: 1.02E-13mmHg at 25°C
• Refractive Index: 1.7500 (estimate)
• Boiling Point: 586.1°C at 760 mmHg
• Flash Point: 308.2°C
• PSA: 149.67000
• Density: 1.663g/cm³
• LogP: 1.88980
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 1
• Exact Mass: 222.05013807
• Heavy Atom Count: 16
• Complexity: 261

Purity/Quality:

99% ^*data from raw suppliers

4,6-DIAMINO-2-(5-NITRO-2-FURYL)-S-TRIAZINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(OC(=C1)[N+](=O)[O-])C2=NC(=NC(=N2)N)N

Technology Process of 4,6-Diamino-2-(5-nitro-2-furyl)-s-triazine

There total 2 articles about 4,6-Diamino-2-(5-nitro-2-furyl)-s-triazine 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:

methyl 5-nitrofuran-2-carboxylate (1874-23-3) + BIGUANIDE (56-03-1) → 6-(5-nitro-furan-2-yl)-[1,3,5]triazine-2,4-diamine (720-69-4)

Guidance literature:

In methanol;

DOI:10.1021/jm00301a010

Reference yield:

5-nitrofuran-2-carboxylic acid ethyl ester (943-37-3) + BIGUANIDE (56-03-1) → 6-(5-nitro-furan-2-yl)-[1,3,5]triazine-2,4-diamine (720-69-4)

Guidance literature:

With methanol;

upstream raw materials:

5-nitrofuran-2-carboxylic acid ethyl ester

BIGUANIDE

methyl 5-nitrofuran-2-carboxylate

Refernces