2,4,6-Tris(prop-2-yn-1-yloxy)-1,3,5-triazine

Base Information

• Chemical Name: 2,4,6-Tris(prop-2-yn-1-yloxy)-1,3,5-triazine
• CAS No.: 15911-93-0
• Molecular Formula: C12H9 N3 O3
• Molecular Weight: 243.222
• Hs Code.: 2933699090
• DSSTox Substance ID: DTXSID90385176
• Nikkaji Number: J1.963.882K
• ChEMBL ID: CHEMBL1365489
• Mol file: 15911-93-0.mol

Synonyms:15911-93-0;2,4,6-tris(prop-2-yn-1-yloxy)-1,3,5-triazine;2,4,6-tris(prop-2-ynoxy)-1,3,5-triazine;2,4,6-Tri(propargyloxy)-1,3,5-triazine;STK047125;2,4,6-tris(prop-2-ynyloxy)-1,3,5-triazine;propargyl cyanurate;CBMicro_004970;Cambridge id 5112000;2,4,6-Tris-prop-2-ynyloxy-[1,3,5]triazine;MLS000104707;SCHEMBL690812;CHEMBL1365489;DTXSID90385176;HMS2288D23;CCG-2081;SMSF0003379;MFCD00441828;2,4,6-Tris(propargyloxy)-s-triazine;AKOS000505220;CB06990;SB73453;SMR000054640;BIM-0004909.P001;tris(prop-2-yn-1-yloxy)-1,3,5-triazine;CS-0337015;SR-01000406295;J-650186;SR-01000406295-1;3-(2-HYDROXY-4,6-DIMETHYL-QUINOLIN-3-YL)-PROPIONICACID

Chemical Property of 2,4,6-Tris(prop-2-yn-1-yloxy)-1,3,5-triazine

Chemical Property:

• Vapor Pressure: 1.34E-05mmHg at 25°C
• Melting Point: 79.5-80.5 °C
• Refractive Index: 1.559
• Boiling Point: 378.8°C at 760 mmHg
• PKA: -0.08±0.10(Predicted)
• Flash Point: 137.8°C
• PSA: 66.36000
• Density: 1.27g/cm³
• LogP: -0.09240
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 243.06439116
• Heavy Atom Count: 18
• Complexity: 323

Purity/Quality:

99% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C#CCOC1=NC(=NC(=N1)OCC#C)OCC#C

Technology Process of 2,4,6-Tris(prop-2-yn-1-yloxy)-1,3,5-triazine

There total 2 articles about 2,4,6-Tris(prop-2-yn-1-yloxy)-1,3,5-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: 90.0%

1,3,5-trichloro-2,4,6-triazine (108-77-0) + propargyl alcohol (107-19-7) → 2,4,6-tris-prop-2-ynyloxy-[1,3,5]triazine (15911-93-0)

Guidance literature:

With potassium carbonate; In tetrahydrofuran; at 60 ℃;

DOI:10.1002/anie.200454078

Reference yield:

→ 2,4,6-tris-prop-2-ynyloxy-[1,3,5]triazine (15911-93-0)

Guidance literature:

Cyanurchlorid, /BRN= 506003/, NaOH;

Reference yield: 90.0%

N1-{[4-(azidomethyl)benzyl]}-N3-benzoyluracil + 2,4,6-tris-prop-2-ynyloxy-[1,3,5]triazine (15911-93-0) → 2,4,6-tris[(1-{4-[(N3-benzoyluracil-1-yl)methyl]benzyl}-1H-1,2,3-triazol-4-yl)methoxy]-1,3,5-triazine

Guidance literature:

With copper(ll) sulfate pentahydrate; sodium L-ascorbate; tris[(1-benzyl-1H-1,2,3-triazol-4yl)methyl]amine; In water; acetonitrile; at 20 ℃; for 48h; Inert atmosphere;

DOI:10.1055/s-0033-1340833

upstream raw materials:

1,3,5-trichloro-2,4,6-triazine

propargyl alcohol

Downstream raw materials:

isocyanuric acid

C₁₀₂H₉₆N₁₈O₂₄

C₃₃H₃₀N₁₂O₃