基本信息
- 标准SMILES
Fc1nc(F)nc(F)n1- InChIKey
VMKJWLXVLHBJNK-UHFFFAOYSA-N- 分子式
- C3F3N3
- 平均分子量
- 135.05 g/mol
- 单同位素质量
- 135.00443166
概述
Cyanuric fluoride is a liquid. (EPA, 1998)
名称与标识
- 首选名称
- Cyanuric fluoride
- IUPAC
- 2,4,6-trifluoro-1,3,5-triazine
- 中文名
- 三聚氟氰
- 英文名
- Cyanuric fluoride
- 分子式
- C3F3N3
- 分子量
- 135.05
名称与别名
展开更多名称
数据库标识
- CAS
675-14-9- PubChem CID
- 12664
- DTXSID
DTXSID6060975- UNII
- 31KW4S5FBB
- EC Number
- 211-620-8
- Nikkaji
- J14.172K
性质
结构计算性质
- XLogP
- 1.3
- 极性表面积
- 38.7 Ų
- 氢键供体
- 0
- 氢键受体
- 6
- 可旋转键
- 0
- 重原子
- 9
- 形式电荷
- 0
- 复杂度
- 69.3
实验与物化性质
Density
1.60 at 25 °C/4 °C
1.60 @25 °C
Boiling Point
72.8 °C
72.4 °C @760 [mm Hg]
Melting Point
-38 °C
-38 °C
Physical Description
Cyanuric fluoride is a liquid. (EPA, 1998)
Colorless liquid; [HSDB]
物理化学性质
- 熔点
- -38 °C · -38°C
- 沸点
- 73 · 73-74°C
- 密度
- 1 · 1,6 g/cm3
- 折射率
- 1.348 · 1.348
- 闪点
- 73 · 73-74°C
- 储存条件
- Hygroscopic, Refrigerator, under inert atmosphere
- 溶解度
- Miscible with chloroform, carbon tetrachloride,ether, dioxane and ketones.
- 酸度系数(pKa)
- -2.62 · -2.62±0.10(Predicted)
- 形态
- Oil
- 颜色
- Clear Colourless
- 敏感性
- Moisture Sensitive
- BRN
- 124237 · 124237
- 暴露限值
- 2.5 mg/m3NIOSH: · ACGIH: TWA 2.5 mg/m3NIOSH: IDLH 250 mg/m3; TWA 2.5 mg/m3
- CAS 数据库
- 675 · 675-14-9(CAS DataBase Reference)
- NIST化学物质信息
- 1 · 1,3,5-Triazine, 2,4,6-trifluoro-(675-14-9)
- EPA化学物质信息
- Cyanuric fluoride (675-14-9)
化学性质
无色液体。沸点69.5-70.5℃。遇水、醇剧烈分解。
安全与法规
GHS分类
GHS Classification
Danger
H310+H330 (16.7%): Fatal in contact with skin or if inhaled [Danger Acute toxicity, dermal; acute toxicity, inhalation]
P260, P262, P264, P264+P265, P270, P271, P280, P284, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P361+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危害信息
Hazards Summary
Cyanuric fluoride is irritating to the skin, eyes, and respiratory tract. Information is limited, but it is not known to cause cyanide poisoning. It is absorbed through the skin. When heated to decomposition, fumes of fluorides and oxides of nitrogen are formed. [HSDB] In high-dose inhalation studies, animals develop pulmonary edema. [ChemIDplus]
CERCLA Reportable Quantities
Releases of CERCLA hazardous substances are subject to the release reporting requirement of CERCLA section 103, codified at 40 CFR part 302, in addition to the requirements of 40 CFR part 355. Cyanuric fluoride is an extremely hazardous substance (EHS) subject to reporting requirements when stored in amounts in excess of its threshold planning quantity (TPQ) of 100 lbs.
安全与防护
First Aid
Signs and Symptoms of Cyanuric Fluoride Exposure: Signs and symptoms of acute exposure to cyanuric fluoride may include irritation or burns of the mucous membranes, lungs, gastrointestinal tract, eyes, and skin. Exposure to cyanuric fluoride may result in pulmonary edema.
Disposal Methods
SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
Protective Action Criteria (PAC)
0.0021 [ppm]
0.023 [ppm]
0.14 [ppm]
Personal Protective Equipment (PPE)
For emergency situations, wear a positive pressure, pressure-demand, full facepiece self-contained breathing apparatus (SCBA) or pressure- demand supplied air respirator with escape SCBA and a fully-encapsulating, chemical resistant suit. (EPA, 1998)
毒理信息
Antidote and Emergency Treatment
Basic treatment: Establish a patent airway (oropharyngeal or nasopharyngeal airway, if needed). Suction if necessary. Watch for signs of respiratory insufficiency and assist ventilations if necessary. Administer oxygen by nonrebreather mask at 10 to 15 L/min. Monitor for pulmonary edema and treat if necessary ... . Monitor for shock and treat if necessary ... . For eye contamination, flush eyes immediately with water. Irrigate each eye continuously with 0.9% saline (NS) during transport ... . Do not use emetics. For ingestion, rinse mouth and administer 5 mL/kg up to 200 mL of water if the patient can swallow, has a strong gag reflex, and does not drool. Do not attempt to neutralize because of exothermic reaction. Cover skin burns with dry, sterile dressings after decontamination ... . /Hydrofluoric Acid (HF) and Related Compounds/
Advanced treatment: Consider orotracheal or nasotracheal intubation for airway control in the patient who is unconscious, has severe pulmonary edema, or is in severe respiratory distress. Consider drug therapy for pulmonary edema ... . Early intubation at the first sign of upper airway obstruction may be necessary. Positive-pressure ventilation with a bag valve mask device may be beneficial. Consider drug therapy for pulmonary edema ... . Monitor cardiac rhythm and treat arrhythmias as necessary. Development of QT interval prolongation may signal hypocalcemia and need for IV calcium gluconate administration ... . Start IV administration of D5W /SRP: "To keep open", minimal flow rate/. Use 0.9% saline (NS) or lactated Ringer's (LR) if signs of hypovolemia are present. For hypotension with signs of hypovolemia, administer fluid cautiously. Consider vasopressors if patient is hypotensive with a normal fluid volume. Watch for signs of fluid overload ... . Use 2.5% calcium gluconate gel for skin burns over painful areas after thorough decontamination ... . Iced 0.13% benzalkonium chloride (Zephiran chloride) solution soak or compresses may be used with careful monitoring of body temperature. Compresses should be changed every 2 min. Use proparacaine hydrochloride to assist eye irrigation ... . /Hydrofluoric Acid (HF) and Related Compounds/
法规信息
CERCLA Reportable Quantities
Releases of CERCLA hazardous substances are subject to the release reporting requirement of CERCLA section 103, codified at 40 CFR part 302, in addition to the requirements of 40 CFR part 355. Cyanuric fluoride is an extremely hazardous substance (EHS) subject to reporting requirements when stored in amounts in excess of its threshold planning quantity (TPQ) of 100 lbs.
安全数据
- F
- 10
- wgk
- 3
- tsca
- TSCA listed
- RTECS号
- XZ1750000
- hazard_note
- Corrosive/Toxic
- 包装类别
- I
- 危险等级
- 6.1
- 安全说明
- 26-28-36/37/39-45
- 危险品标志
- T+,C,T
- 危险类别码
- 24-26-35
- 毒害物质数据
- 675-14-9(Hazardous Substances Data)
- 危险品运输编号
- UN 3389 6.1/PG 1
化学与工业
用途与制造
Uses
Used to produce fiber-reactive dyes; [HSDB]
... Used to manufacture reactive dyes.
Specific reagent for tyrosine residues in enzymes ... can also serve as a fluorinating agent in fluorodehydroxylation reactions ... preparation of acid fluorides from the corresponding carboxylic acid ... application in peptide syntheis from amino acids through the corresponding acid fluoride.
Used to manufacture reactive dyes by reaction between one or two fluorine substituents with amino groups of chromophores; the remaining fluorine binds to the fiber
Methods of Manufacturing
Can be prepared from cyanuric chloride with numerous fluorinating agents, eg, pentavalent antimony chlorofluoride, silver monofluoride, potassium fluoride, sodium fluoride, potassium fluorosulfinate, and sulfur tetrafluoride ... .
2,4,6-Trifluoro-1,3,5-triazine ... is produced commercially from 2,4,6-trichloro-1,3,5-triazine (cyanuric chloride) with either anhydrous hydrogen fluoride or sodium fluoride in sulfolane.
General Manufacturing Information
1,3,5-Triazine, 2,4,6-trifluoro-: ACTIVE
Cyanuric fluoride has been offered commercially for biochemical applications, eg, as a specific reagent for tyrosine.
应用领域
概述三聚氟氰是合成氟代均三嗪活性染料的关键中间体。氟代均三嗪活性染料与传统的氯代三嗪活性染料相比, 具有以下五大优点: 1.节能, 染色温度低(中温型)60℃, 比KE型活性染料低, 与M型活性染料相当。 2.减排、环保、固色率高, 比相应的氯代三嗪活性染料固色率高15 ~ 20个百分点, 既可提高染料的利用率, 又可减少印染过程中的环境污染。 3.染料稳定性好。 4.耐过氧化物稳定性高。 5.不受AOX法规限制。
用途用于制备活性染料。 有关三聚氟氰的概述、合成、用途是由Chemicalbook的侍艳编辑整理。(2015-11-16)
用途用于有机合成。
用途主要用于制备活性染料
制备方法
生产方法在聚乙烯容器中,加入氰尿酰氯,冷至-78℃,通入干燥的氟化氢气体,氟化氢被冷凝,氰尿酰氯慢慢溶解,当氰尿酰氯全部溶解,反应产生的氯化氢先在低温下逸出,继续在室温下逸出,当不再有氯化氢逸出时,反应即告完成。稍加热并通氮气除去过量的氟化氢,在聚乙烯装置中蒸馏,得氰尿酰氟。产率76%。
上下游产品信息
上游原料
试剂价格
- XW0267514903 · 25G
- 氰尿酰氟 — 1134元
- XW0267514902 · 10G
- 氰尿酰氟 — 512元
供应商50 家
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