6-(Phenylamino)-1,3,5-triazine-2,4-dithiol

Base Information

• Chemical Name: 6-(Phenylamino)-1,3,5-triazine-2,4-dithiol
• CAS No.: 13733-91-0
• Molecular Formula: C₉H₈N₄S₂
• Molecular Weight: 236.321
• Hs Code.: 2933699090
• DSSTox Substance ID: DTXSID40160137
• Nikkaji Number: J32.477I
• Mol file: 13733-91-0.mol

Synonyms:13733-91-0;6-(Phenylamino)-1,3,5-triazine-2,4-dithiol;6-Anilino-1,3,5-triazine-2,4-dithiol;6-anilino-1H-1,3,5-triazine-2,4-dithione;1,3,5-Triazine-2,4(1H,3H)-dithione, 6-(phenylamino)-;6-(Phenylamino)-1,3,5-triazine-2,4(1H,3H)-dithione;Zisnet AF;2-Anilino-4,6-dimercapto-1,3,5-triazine;SCHEMBL1152315;SCHEMBL10615799;DTXSID40160137

Chemical Property of 6-(Phenylamino)-1,3,5-triazine-2,4-dithiol

Chemical Property:

• Vapor Pressure: 6.6E-05mmHg at 25°C
• Melting Point: 243 °C
• Boiling Point: 344.4°C at 760 mmHg
• PKA: 4.31±0.20(Predicted)
• Flash Point: 162.1°C
• PSA: 128.30000
• Density: 1.5g/cm³
• LogP: 2.26560
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 236.01903862
• Heavy Atom Count: 15
• Complexity: 307

Purity/Quality:

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

6-(Phenylamino)-1,3,5-triazine-2,4-dithiol 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC2=NC(=S)NC(=S)N2

Technology Process of 6-(Phenylamino)-1,3,5-triazine-2,4-dithiol

There total 1 articles about 6-(Phenylamino)-1,3,5-triazine-2,4-dithiol 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:

→ 6-anilino-1,3,5-triazine-2,4-dithiol (13733-91-0)

Guidance literature:

2-Anilino-4,6-dichlor-1,3,5-triazin, H2S;

DOI:10.1039/j39670000466

Reference yield: 92.0%

cobalt(II) chloride hexahydrate + water (7732-18-5) + 6-anilino-1,3,5-triazine-2,4-dithiol (13733-91-0) → [H3O][Co(II)4Co(III)2Cl3(6-anilino-1,3,5-triazine-2,4-dithiolate)6]·H2O

Guidance literature:

In acetonitrile; at 160 ℃; for 72h;

DOI:10.1039/c3dt50165e

Reference yield: 90.0%

copper(l) iodide (7681-65-4) + N,N-dimethyl-formamide (68-12-2,33513-42-7) + 6-anilino-1,3,5-triazine-2,4-dithiol (13733-91-0) → [Cu6(4-dimethylamino-6-anilino-1,3,5-triazine-2-thiolate)6]

Guidance literature:

In N,N-dimethyl-formamide; at 150 ℃; for 72h;

DOI:10.1039/c3dt50165e