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2-Propenoic acid,1,1',1''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tri-2,1-ethanediyl]ester

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Name

2-Propenoic acid,1,1',1''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tri-2,1-ethanediyl]ester

EINECS 254-843-6
CAS No. 40220-08-4 Density 1.298 g/cm3
PSA 144.90000 LogP -1.64070
Solubility 1.497g/L at 20.1℃ Melting Point 52-53 °C(lit.)
Formula C18H21N3O9 Boiling Point 568.258 ºC at 760 mmHg
Molecular Weight 423.379 Flash Point 297.472 ºC
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 40220-08-4 (ISOCYANURIC ACID TRIS(2-ACRYLOYLOXYETHYL) ESTER) Hazard Symbols IrritantXi
Synonyms

2-Propenoicacid, (2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tri-2,1-ethanediylester (9CI);A 9300;Aronix M 315;CN 936;Ebecryl IRR 264;FA 731A;Fancryl FA731A;GX 8430;Genomer T 930;M 315;NK Ester A 9300;Newfrontier GX 8430;Newfrontier TEICA;SR 360;SR 368;Sartomer 368;Sartomer 369;Sartomer SR 368;THEICTA;Tris(2-acryloxyethyl) isocyanurate;Tris(2-hydroxyethyl) isocyanuratetriacrylate;Tris(2-hydroxyethyl)isocyanuric acid triacrylate;Tris(acryloyloxyethyl) isocyanurate;Tris(b-acryloyloxyethyl) isocyanurate;Tris[2-(acryloyloxy)ethyl] isocyanurate;

Article Data 3

2-Propenoic acid,1,1',1''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tri-2,1-ethanediyl]ester Specification

The 2-Propenoic acid,1,1',1''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tri-2,1-ethanediyl]ester, with its CAS registry number 40220-08-4, has the IUPAC name of 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate. And its product categories are including Acrylic Monomers; Monomers; Polyfunctional Acrylics.

The characteristics of this chemical are as follows: (1)ACD/LogP: 0.86; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.864; (4)ACD/LogD (pH 7.4): 0.864; (5)ACD/BCF (pH 5.5): 2.671; (6)ACD/BCF (pH 7.4): 2.671; (7)ACD/KOC (pH 5.5): 70.315; (8)ACD/KOC (pH 7.4): 70.315; (9)#H bond acceptors: 12; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 139.83; (13)Index of Refraction: 1.52; (14)Molar Refractivity: 99.102 cm3; (15)Molar Volume: 326.138 cm3; (16)Polarizability: 39.287×10-24 cm3; (17)Surface Tension: 48.356 dyne/cm; (18)Density: 1.298 g/cm3; (19)Flash Point: 297.472 °C; (20)Enthalpy of Vaporization: 85.284 kJ/mol; (21)Boiling Point: 568.258 °C at 760 mmHg; (22)Exact Mass: 423.127779 (23)MonoIsotopic Mass: 423.127779 (24)Topological Polar Surface Area: 140 (25)Heavy Atom Count: 30 (26)Complexity: 638.

When you are dealing with this chemical, you should be careful. This chemical is irritating to eyes, respiratory system and skin and may then cause inflammation to the skin or other mucous membranes. Therefore, you should wear suitable protective clothing and if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

In addition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C
(2)InChI: InChI=1S/C18H21N3O9/c1-4-13(22)28-10-7-19-16(25)20(8-11-29-14(23)5-2)18
(27)21(17(19)26)9-12-30-15(24)6-3/h4-6H,1-3,7-12H2
(3)InChIKey: YIJYFLXQHDOQGW-UHFFFAOYSA-N 

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