基本情報
- CAS
606-03-1- 標準SMILES
O=c1n(Cc2ccccc2)c(=O)n(Cc2ccccc2)c(=O)n1Cc1ccccc1- InChIKey
PIBKGXNSYQOGKL-UHFFFAOYSA-N- 分子式
- C24H21N3O3
- 平均分子量
- 399.4 g/mol
- 単同位体質量
- 399.15829154
名称と識別子
- 優先名称
- Tribenzyl isocyanurate
- IUPAC
- 1,3,5-tribenzyl-1,3,5-triazinane-2,4,6-trione
- 現地名
- 1,3,5-トリベンジル-1,3,5-トリアジン-2,4,6(1H,3H,5H)-トリオン
- 英語名
- 1,3,5-tribenzyl-1,3,5-triazine-2,4,6(1H,3H,5H)-trione
- 分子式
- C24H21N3O3
- 分子量
- 399.44
名称と別名
TRIBENZYL ISOCYANURATEAZR3535V8J1,3,5-Tribenzyl-1,3,5-triazine-2,4,6(1H,3H,5H)-trione1,3,5-tribenzyl-1,3,5-triazinane-2,4,6-trioneEINECS 210-102-9DTXSID40748511,3,5-TRIS(PHENYLMETHYL)-1,3,5-TRIAZINE-2,4,6(1H,3H,5H)-TRIONERefChem:190885DTXCID90428371,3,5-TRIBENZYL-S-TRIAZINE-2,4,6(1H,3H,5H)-TRIONE1,3,5-TRIBENZYL ISOCYANURATETRIBENZYL-S-'TRIAZINE-2,4,6(1H,3H,5H)-TRIONE
名称をさらに表示
ベンジルイソシアヌル酸1,3,5-トリベンジル-1,3,5-トリアジン-2,4,6(1H,3H,5H)-トリオントリベンジル-1,3,5-トリアジナン-2,4,6-トリオン1,3,5-トリベンジル-s-トリアジン-2,4,6(1H,3H,5H)-トリオン1,3,5-トリベンジルヘキサヒドロ-1,3,5-トリアジン-2,4,6-トリオンBenzyl isocyanurate1,3,5-tris(benzyl)isocyanuric acid1,3,5-tris(phenylmethyl)-1,3,5-triazinane-2,4,6-trione
S-TRIAZINE-2,4,6(1H,3H,5H)-TRIONE, TRIBENZYL-S-TRIAZINE-2,4,6(1H,3H,5H)-TRIONE, 1,3,5-TRIBENZYL-606-03-11,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3,5-tris(phenylmethyl)-UNII-AZR3535V8JSCHEMBL8985073PIBKGXNSYQOGKL-UHFFFAOYSA-NNS00043031
データベース識別子
- CAS
606-03-1- PubChem CID
- 11805
- DTXSID
DTXSID4074851- UNII
- AZR3535V8J
- EC Number
- 210-102-9
- Nikkaji
- J95.776C
物性
構造計算による物性
- XLogP
- 3.9
- 極性表面積
- 60.9 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 3
- 回転可能結合数
- 6
- 重原子数
- 30
- 形式電荷
- 0
- 複雑度
- 510
物理化学的性質
- 安定性
- 安定性可燃性。強力な酸化剤とは相容れない。
- CAS データベース
- 606 · 606-03-1
- EPAの化学物質情報
- Tribenzyl isocyanurate (606-03-1)
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
危険有害性情報
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Reactive GroupIsocyanates and Isothiocyanates
Reactivity Profile
Isocyanates and thioisocyanates, such as TRIBENZYL ISOCYANURATE, are incompatible with many classes of compounds, reacting exothermically to release toxic gases. Reactions with amines, aldehydes, alcohols, alkali metals, ketones, mercaptans, strong oxidizers, hydrides, phenols, and peroxides can cause vigorous releases of heat. Acids and bases initiate polymerization reactions in these materials. Some isocyanates react with water to form amines and liberate carbon dioxide. Base-catalysed reactions of isocyanates with alcohols should be carried out in inert solvents. Such reactions in the absence of solvents often occur with explosive violence, [Wischmeyer(1969)].
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
安全と保護具
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill ResponseSTORAGE PRECAUTIONS: You should store this material in a refrigerator. (NTP, 1992)
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)
化学と産業
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