CAS 101-37-1 Triallyl cyanurate (HCID 7555)

名称と識別子

優先名称: Triallyl cyanurate
IUPAC: 2,4,6-tris(prop-2-enoxy)-1,3,5-triazine
現地名: シアヌル酸トリアリル
英語名: 2,4,6-Triallyloxy-1,3,5-triazi
分子式: C12H15N3O3
分子量: 249.27

名称と別名

Triallyl cyanurate101-37-1Triallyl cyanaurateActivator OC2,4,6-Tris(allyloxy)-1,3,5-triazinePerkalink 300Rhenofit TACCyanuric acid triallyl ester1,3,5-Triazine, 2,4,6-tris(2-propenyloxy)-Cyanuric acid, tri-2-propenyl esterRhenogran TAC/SRhenofit TAC/S

名称をさらに表示

シアヌル酸トリアリルシアヌル酸トリプロパルギルトリアリルシアヌラートトリアリルシアナウラート2,4,6-トリ(アリルオキシ)-1,3,5-トリアジン2,4,6-トリ(2-プロペニルオキシ)-1,3,5-トリアジンシアヌル酸トリアリル2,4,6-トリス(アリルオキシ)-1,3,5-トリアジン1,3,5-トリアジン-2,4,6-トリイルトリス(アリルエーテル)2,4,6-トリス(2-プロペニルオキシ)-1,3,5-トリアジントリアリルシアヌレート2，4，6-トリアリロキシ-1，3，5-トリアジン2,4,6-トリアリルオキシ-1,3,5-トリアジンTAC5-T- TACTAC-70FARIDA TACactivatorocrhenofittac

Sartomer SR 507s-Triazine, 2,4,6-tris(allyloxy)-DTXSID8037754PLC 50BCTAC-DL 70CDD3388O1DNSC-4804NSC-49121

データベース識別子

CAS: 101-37-1
PubChem CID: 7555
DTXSID: DTXSID8037754
ChEMBL: CHEMBL2145133
ChEBI: CHEBI:191000
UNII: CDD3388O1D
EC Number: 202-936-7
Nikkaji: J39.663J

物性

構造計算による物性

XLogP: 2.8
極性表面積: 66.4 Å²
水素結合供与体数: 0
水素結合受容体数: 6
回転可能結合数: 9
重原子数: 18
形式電荷: 0
複雑度: 218

実験および物理化学的性質

Physical Description · 2 件

Liquid; Large Crystals

Colorless liquid; mp = 26-27 deg C; [Sigma-Aldrich MSDS]

Collision Cross Section · 1 件

175.0 Å² [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID8037754]；154.4 Å² [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID8037754]；154.2 Å² [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID8037754]

物理化学的性質

融点: 26 · 26-28 °C
沸点: 156 °C · 156 °C
比重(密度): 1.11 g/mL · 1.11 g/mL at 30 °C
蒸気圧: 1.3 hPa · 1.3 hPa (100 °C)
屈折率: 1.529 · 1.5290 (estimate)
闪点: 230 °F · >230 °F
貯蔵温度: 20 °C · Store at <= 20°C.
溶解性: 0.3 g/l · 0.3g/l
酸解離定数(Pka): 2.04 · 2.04±0.10(Predicted)
外見: 油
色: 無色
比重: 1.11 · 1.11
水溶解度: 6 g/L · 6g/L(20℃)
BRN: 235560 · 235560
Henry's Law Constant: 2.3 · 2.3×101 mol/(m3Pa) at 25℃, Zhang et al. (2010)
安定性: 安定していますが、湿気に弱いです。酸、過酸化物、強力な酸化剤、銅、鉄およびそれらの塩とは相容れない。
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
InChIKey: BJELTSYBAHKXRW-UHFFFAOYSA-N
SMILES: C=CCOc1nc(OCC=C)nc(OCC=C)n1
LogP: 3.51 at · 3.51 at 20℃
CAS データベース: 101 · 101-37-1(CAS DataBase Reference)
NISTの化学物質情報: 2 · 2,4,6-Triallyloxy-1,3,5-triazine(101-37-1)
EPAの化学物質情報: 1 · 1,3,5-Triazine, 2,4,6-tris(2-propenyloxy)- (101-37-1)

化学的性質

化学的特性Colorless liquid or solid. Miscible with acetone, benzene, chloroform, dioxane, ethyl acetate, ethanol, and xylene. Combustible.

安全と法規制

GHS分類

GHS Classification · 6 件

Warning

H302 (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.

危険有害性情報

Regulatory Information · 4 件

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/15607

2,4,6-Tris(allyloxy)-1,3,5-triazine: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 件

Causes somnolence in inhalation lethal-concentration studies of rats and dermal lethal-dose studies of rabbits; Causes lachrymation, somnolence, and changes in the structure or function of salivary glands in oral lethal-dose studies of rats; Causes 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 irritation; Harmful by ingestion; [Sigma-Aldrich MSDS] See Sodium cyanurate.

History and IncidentsApril 12, 2004, the MFG Chemical Inc. unintended decomposition reaction, 154 hospitalized

Hazard Classes and Categories · 2 件

Acute Tox. 4 (100%)；Aquatic Chronic 2 (100%)

Acute toxicity (Oral) - Category 4；Specific target organ toxicity - Single exposure - Category 2 (central nervous system)；Specific target organ toxicity - Repeated exposure - Category 2 (central nervous system, liver)

毒性情報

Toxicity DataLC50 (rat) > 333 mg/m3/1hr

法規制情報

Regulatory Information · 4 件

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/15607

2,4,6-Tris(allyloxy)-1,3,5-triazine: Does not have an individual approval but may be used under an appropriate group standard

安全データ

F: 21
wgk: 2
tsca: TSCA listed
rtecs: XZ2080000
ridadr: UN 3077 9/PG 3
毒性: LD50 orally in Rabbit: 753 mg/kg LD50 dermal Rabbit > 2000 mg/kg
hs_code: 2933 69 80
risk_code: 22-51/53
化審法: (5)-1059
hazard_code: Xn,N
safety_code: 36-61
hazard_class: 6.1(b)
packing_group: III
Hazard Classifications: Acute Tox. 4 OralAquatic Chronic 2
ストレージクラス: 11 - Combustible Solids

化学と産業

用途と製造

UsesUsed for laboratory research; [Sigma-Aldrich MSDS]

U.S. Production2023: 250,000 - <400,000 lb；2022: 250,000 - <400,000 lb；2021: 250,000 - <400,000 lb；2020: 250,000 - <400,000 lb

Consumer UsesProcessing aids not otherwise specified

Industry UsesOther；Processing aids not otherwise specified

General Manufacturing Information · 2 件

Synthetic Rubber Manufacturing；Rubber Product Manufacturing；Plastics Material and Resin Manufacturing；Paint and Coating Manufacturing；All Other Chemical Product and Preparation Manufacturing

1,3,5-Triazine, 2,4,6-tris(2-propen-1-yloxy)-: ACTIVE

応用分野 · 3 件

用途架橋用コモノマーとして各種ビニルポリマーの強度,耐熱性の改質に用いる。たとえばタイヤコード用接着剤,後架橋硬化型の塩化ビニル樹脂,ポリエチレン,エチレン系共重合体,フッ素ゴム,ケイ素ゴム等に用いられる。

用途有機合成原料。

使用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.

上流・下流製品情報

上流原料

アリルアルコールシアヌル酸クロリド

サプライヤー100 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

江西益众化工有限公司15307925109 15350027073 · [email protected]

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

湖北宥澄新材料科技有限公司17764017698 13163370568 · [email protected]

化合物ノート

読み込み中…

シアヌル酸トリアリル

基本情報