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HCID 7555Erstellt: 26. Oktober 2026
2,4,6-Triallyloxy-1,3,5-triazin
TAC · TRIALLYL CYANURATE · 2,4,6-TRIS(ALLYLOXY)-1,3,5-TRIAZINE · 1,3,5-Triazine, 2,4,6-tris(2-propenyloxy)- · 5-T · - TAC · TAC-70 · FARIDA TAC
https://huagongshe.com/de/chemical/7555
Identifikatoren & physikalische Daten
| CAS No. | 101-37-1 |
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| Summenformel | C12H15N3O3 |
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| Durchschnittliche Molmasse | 249,27 g/mol |
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| Monoisotopische Masse | 249,11134135 g/mol |
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| SMILES | C=CCOc1nc(OCC=C)nc(OCC=C)n1 |
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| InChIKey | BJELTSYBAHKXRW-UHFFFAOYSA-N |
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| PubChem CID | 7555 |
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| ChEMBL | CHEMBL2145133 |
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| ChEBI | CHEBI:191000 |
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| EC No. | 202-936-7 |
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| DTXSID | DTXSID8037754 |
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| Lokaler Name | 2,4,6-Triallyloxy-1,3,5-triazin |
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Chemische & physikalische Eigenschaften
| XLogP | 2,8 |
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| Polarare Oberfläche (TPSA) | 66,4 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 6 |
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| Frei drehbare Bindungen | 9 |
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| Schwere Atome | 18 |
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| Formalladung | 0 |
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| Komplexität | 218 |
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| Physical Description | LiquidLarge CrystalsColorless liquidmp = 26-27 deg C[Sigma-Aldrich MSDS] |
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| Collision Cross Section | 175.0 Ų [M+Na]+ [CCS Type: DTBuffer gas: N2Ionization: ESI+Dataset: TOXCASTSource Identifier: DTXSID8037754]154.4 Ų [M+H]+ [CCS Type: DTIonization: APCI+154.2 Ų [M+H]+ [CCS Type: DT |
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| Schmelzpunkt | 26-28 °C |
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| Siedepunkt | 156 °C |
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| Dichte | 1.11 g/mL at 30 °C |
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| Dampfdruck | 1.3 hPa (100 °C) |
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| Brechungsindex | 1.5290 (estimate) |
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| Flammpunkt | >230 °F |
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| Lagerbedingungen | Store at <= 20°C. |
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| Löslichkeit | 0.3g/l6g/L(20 ºC) |
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| pKa (Säurekonstante) | 2.04±0.10(Predicted) |
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| Aggregatzustand | Oil |
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| Farbe | Colourless |
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| Wichte | 1.11 |
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| BRN | 235560 |
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| Henry-Konstante | 2.3×101 mol/(m3Pa) at 25℃, Zhang et al. (2010) |
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| Stabilität | Stable, but moisture-sensitive. Incompatible with acids, peroxides, strong oxidizing agents, copper, iron and its salts. |
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| InChI | 1S/C12H15N3O3/c1-4-7-16-10-13-11(17-8-5-2)15-12(14-10)18-9-6-3/h4-6H,1-3,7-9H2 |
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| InChIKey | BJELTSYBAHKXRW-UHFFFAOYSA-N |
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| SMILES | C=CCOc1nc(OCC=C)nc(OCC=C)n1 |
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| LogP (Verteilungskoeffizient) | 3.51 at 20℃ |
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| CAS Datenbank | 101-37-1(CAS DataBase Reference) |
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| NIST chemische Informationen | 2,4,6-Triallyloxy-1,3,5-triazine(101-37-1) |
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| EPA chemische Informationen | 1,3,5-Triazine, 2,4,6-tris(2-propenyloxy)- (101-37-1) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 261 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
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| Regulatorische Informationen | Chemical: 1,3,5-Triazine, 2,4,6-tris(2-propenyloxy)-1,3,5-Triazine, 2,4,6-tris(2-propen-1-yloxy)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3,5-Triazine, 2,4,6-tris(2-propen-1-yloxy)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 07-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/156072,4,6-Tris(allyloxy)-1,3,5-triazine: Does not have an individual approval but may be used under an appropriate group standard |
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| Gefahrenübersicht | Causes somnolence in inhalation lethal-concentration studies of rats and dermal lethal-dose studies of rabbitsCauses lachrymation, somnolence, and changes in the structure or function of salivary glands in oral lethal-dose studies of ratsCauses altered sleep time (including change in righting reflex), convulsions, and effects on other transferases in 28-day constant oral studies of rats[RTECS] May cause irritationHarmful by ingestion[Sigma-Aldrich MSDS] See Sodium cyanurate. |
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| History and Incidents | April 12, 2004, the MFG Chemical Inc. unintended decomposition reaction, 154 hospitalized |
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| Hazard Classes and Categories | Acute Tox. 4 (100%)Aquatic Chronic 2 (100%)Acute toxicity (Oral) - Category 4Specific target organ toxicity - Single exposure - Category 2 (central nervous system)Specific target organ toxicity - Repeated exposure - Category 2 (central nervous system, liver) |
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| Toxicity Data | LC50 (rat) > 333 mg/m3/1hr |
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| F | 21 |
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| Wassergefährdungsklasse (WGK) | 2 |
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| TSCA-Inventar-Status | TSCA listed |
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| UN-Transportnummer | UN 3077 9/PG 3 |
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| Zollcode | 2933 69 80 |
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| RTECS-Nr. | XZ2080000 |
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| R-Sätze (R) | 22-51/53 |
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| Toxizität | LD50 orally in Rabbit: 753 mg/kg LD50 dermal Rabbit > 2000 mg/kg |
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| Gefahrensymbole | Xn,N |
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| Sicherheitshinweise (S) | 36-61 |
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| Gefahrenklasse | 6.1(b)Acute Tox. 4 OralAquatic Chronic 2 |
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| Verpackungsgruppe | III |
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| Lagerklasse | 11 - Combustible Solids |
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Anwendungen & Verwendung
Verwenden
Polymers as monomer and modifier, organic intermediate. Triallyl Cyanurate is used preferentially as a cross-linking agent in copolymers. On heating it may polymerize violently and then isomerize to the more stable triallyl isocyanurate [1025-15-6] with the allyl groups attached to the nitrogen atoms. At 30 ℃ viscous solutions of prepolymers form slowly. Triallyl cyanurate is used for the production of heat- and solvent-resistant coatings and moldings, reinforced plastics, and adhesives. Addition of 5 – 10% triallyl cyanurate to polyester – styrene or methyl methacrylate yields cast sheets of improved mechanical and thermal stability. Short-term heating of triallyl cyanurate with polymers in the presence of peroxides at 180 ℃ gives cross-linking; valuable copolymers are thus obtained from poly(vinyl chloride) elastomers and fluoroelastomers. Ethylene polymers and copolymers also may be crosslinked under similar reaction conditions. High-impact plastics have been obtained by grafting butyl acrylate-triallyl cyanurate copolymer with a styrene – acrylonitrile mixture. Other examples of peroxide-initiated curing with triallyl cyanurate (2 – 5 %) at 150 – 160 ℃ are polyurethanes, nylons, cellulose, polyoxyethylene, vinyl-substituted polysiloxanes, and acrylate copolymers. Crosslinking of polycarbonate with triallyl cyanurate by UV irradiation in the presence of polythiols gives scratch-resistant coatings.
