1,3,5-Triacryloylhexahydro-1,3,5-triazine

Base Information

• Chemical Name: 1,3,5-Triacryloylhexahydro-1,3,5-triazine
• CAS No.: 959-52-4
• Deprecated CAS: 136510-67-3,31426-62-7,85996-24-3,166516-55-8,166516-55-8,31426-62-7,85996-24-3
• Molecular Formula: C12H15 N3 O3
• Molecular Weight: 249.269
• Hs Code.: 29336990
• European Community (EC) Number: 213-501-6
• NSC Number: 63839,8185
• UNII: P69A1S76RB
• DSSTox Substance ID: DTXSID8052645
• Nikkaji Number: J39.660E
• Wikidata: Q27286283
• Mol file: 959-52-4.mol

Synonyms:1,3,5-triacryloylhexahydro-s-triazine;1,3,5-triacryloylhexahydrotriazine;hexahydro-1,3,5-triacryloyl-s-triazine;hexahydro-1,3,5-tris(1-oxo-2-propenyl)-1,3,5-triazine;triacryloylhexahydro-s-triazine

Chemical Property of 1,3,5-Triacryloylhexahydro-1,3,5-triazine

Chemical Property:

• Vapor Pressure: 1.98E-13mmHg at 25°C
• Melting Point: 156 °C (dec.)(lit.)
• Refractive Index: 1.539
• Boiling Point: 579.6 °C at 760 mmHg
• PKA: -1.00±0.20(Predicted)
• Flash Point: 301 °C
• PSA: 60.93000
• Density: 1.197 g/cm³
• LogP: -0.27000
• Water Solubility.: Slightly soluble in water
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 249.11134135
• Heavy Atom Count: 18
• Complexity: 343

Purity/Quality:

99.9% ^*data from raw suppliers

1,3,5-Triacryloylhexahydro-1,3,5-triazine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T,Xi
• Statements: 23/24/25-34-42/43
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C=CC(=O)N1CN(CN(C1)C(=O)C=C)C(=O)C=C

Technology Process of 1,3,5-Triacryloylhexahydro-1,3,5-triazine

There total 3 articles about 1,3,5-Triacryloylhexahydro-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: 95.1%

1,3,5-Trioxan (110-88-3) + acrylonitrile (107-13-1,25014-41-9) → 1,3,5-triacryloylhexahydro-s-triazine (959-52-4)

Guidance literature:

1,3,5-Trioxan; acrylonitrile; With sulfuric acid; In chlorobenzene; at 80 ℃; for 5h;

With sodium hydroxide; In chlorobenzene; at 5 - 20 ℃; for 2h;

Reference yield: 95.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + acrylonitrile (107-13-1,25014-41-9) → 1,3,5-triacryloylhexahydro-s-triazine (959-52-4)

Guidance literature:

Amberlyst 15 resin; In chlorobenzene; at 80 ℃; for 4h;

DOI:10.1055/s-1986-31730

Reference yield:

→ 1,3,5-triacryloylhexahydro-s-triazine (959-52-4)

Guidance literature:

DOI:10.1055/s-1976-24085

upstream raw materials:

1,3,5-Trioxan

acrylonitrile

formaldehyd

Downstream raw materials:

1,3,5-tripropionylperhydro-1,3,5-triazine

Refernces

• 1、 Shirshin,Kazantsev,Danov. "Synthesis of Hexahydro-1,3,5-triacryloyltriazine". . p. 113 - 116. Retrieved 2007/10/03.