2421-28-5

• 常用中文名：3,3'4,4'-二苯甲酮四羧酸二酐
• 常用英文名：4,4'-CARBONYLBIS(PHTHALIC ANHYDRIDE)
• CAS号：2421-28-5
• 分子式：C₁₇H₆O₇
• 分子量：322.225
• 相关类别： 有机原料 羧酸类化合物及衍生物 羧酸酐的卤化、磺化、硝化或硝化衍生物
• 发布时间：2019-01-02 12:51:30
• 更新时间：2024-01-03 19:14:03
• 下载msds

名称

• 中文名: 3,3',4,4'-二苯甲酮四甲酸二酐
• 英文名: 5-(1,3-dioxo-2-benzofuran-5-carbonyl)-2-benzofuran-1,3-dione
• 中文别名: 3,3',4,4'-二苯酮四羧酸二酐; 4,4'-羰基二邻苯二甲酸酐; 3,3'4,4'-二苯甲酮四羧酸二酐; 3,3’,4,4’-二苯酮四酸二酐
• 英文别名: 1,3-Isobenzofurandione, 5,5'-carbonylbis-; benzophenone-3,3',4,4'-tetracarboxylic acid dianhydride; 3,4,3',4'-benzophenone tetracarboxylic dianhydride; Benzophenone-3,3',4,4'-tetracarboxylic dianhydride; 5,5'-Carbonylbis(2-benzofuran-1,3-dione); 3,3,4,4-Benzophenonetetracarboxylic dianhydride; 3,3',4,4'-benzophenonetetracarboxylic dianhydride; 4,4'-Diphthalic anhydride ketone; benzophenone tetracarboxylic dianhydride; Benzophenonetetracarboxylic acid dianhydride; Phthalic anhydride,4,4'-carbonyldi; 3,3‘,4,4‘-Benzophenonetetracarboxylic dianhydride; 1,3-Isobenzofurandione,5,5'-carbonylbis; 5,5'-Carbonylbis(isobenzofuran-1,3-dione); EINECS 219-348-1; 4,4'-CARBONYLBIS(PHTHALIC ANHYDRIDE); MFCD00005923; Benzophenonetetracarboxylic anhydride; 5-(1,3-dioxo-isobenzofuran-5-carbonyl)-isobenzofuran-1,3-dione; Benzophenone-tetracarboxylic-dianhydride; 4,4'-Carbonyldiphthalic anhydride

物化性质

• 密度: 1.7±0.1 g/cm3
• 沸点: 638.8±40.0 °C at 760 mmHg
• 熔点: 218-222 °C(lit.)
• 分子式: C₁₇H₆O₇
• 分子量: 322.225
• 闪点: 286.1±27.4 °C
• 精确质量: 322.011353
• PSA: 103.81000
• LogP: 1.94
• 外观性状: 无气味的淡黄色粉末固体
• 蒸汽密度: 1.4 (vs air)
• 蒸汽压: 0.0±1.9 mmHg at 25°C
• 折射率: 1.700
• 储存条件:

  保持容器密封，放入紧密的出藏器内，储存在阴凉，干燥的地方

• 稳定性:

  常温常压下稳定，避免氧化物，水分接触，

• 水溶解性: 起反应
• 分子结构:

  1、 摩尔折射率：74.90

  2、 摩尔体积（m³/mol）：193.8

  3、 等张比容（90.2K）：578.1

  4、 表面张力（dyne/cm）：79.2

  5、 极化率（10 ^-24cm ³）：29.69

• 计算化学:

  1.疏水参数计算参考值（XlogP）:2

  2.氢键供体数量:0

  3.氢键受体数量:7

  4.可旋转化学键数量:2

  5.互变异构体数量:无

  6.拓扑分子极性表面积104

  7.重原子数量:24

  8.表面电荷:0

  9.复杂度:597

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

• 更多:

  1. 性状：浅黄色粉末

  2. 密度（g/mL, ,20℃）：1.57

  3. 相对蒸汽密度（g/mL,空气=1）：未确定

  4. 熔点（ºC）：215-217

  5. 沸点（ºC,常压）：未确定

  6. 沸点（ºC 5mmHg）：320

  7. 折射率（nD20）：未确定

  8. 闪点（ºC）：未确定

  9. 比旋光度（）：未确定

  10. 自燃点或引燃温度（ºC）：未确定

  11. 蒸气压（Pa,20ºC）：未确定

  12. 饱和蒸气压（kPa, 0ºC）：<0.013

  13. 燃烧热（KJ/mol）：未确定

  14. 临界温度（ºC）：未确定

  15. 临界压力（KPa）：未确定

  16. 油水（辛醇/水）分配系数的对数值：未确定

  17. 爆炸上限（%,V/V）：16vol%

  18. 爆炸下限（%,V/V）：4.2 vol%

  19. 溶解性：未确定

MSDS

Name: 3 3 4 4 -Benzophenonetetracarboxylic dianhydride 96% Material Safety Data Sheet Synonym: 4,4'-Carbonyldiphthalic anhydride, BTD CAS: 2421-28-5 Section 1 - Chemical Product MSDS Name:3 3 4 4 -Benzophenonetetracarboxylic dianhydride 96% Material Safety Data Sheet Synonym:4,4'-Carbonyldiphthalic anhydride, BTD Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS CAS# Chemical Name content EINECS# 2421-28-5 3,3',4,4'-Benzophenonetetracarboxylic 96.0 219-348-1 Hazard Symbols: XI Risk Phrases: 36/37 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Irritating to eyes and respiratory system.The toxicological properties of this material have not been fully investigated.Moisture sensitive. Potential Health Effects Eye: Causes eye irritation. Skin: May cause skin irritation. Ingestion: May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated. Inhalation: Causes respiratory tract irritation. The toxicological properties of this substance have not been fully investigated. Chronic: No information found. Section 4 - FIRST AID MEASURES Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid. Skin: Get medical aid. Flush skin with plenty of soap and water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Ingestion: If victim is conscious and alert, give 2-4 cupfuls of milk or water. Never give anything by mouth to an unconscious person. Get medical aid. Wash mouth out with water. Inhalation: Remove from exposure to fresh air immediately. If not breathing, give artificial respiration. Get medical aid. Notes to Physician: Treat symptomatically and supportively. Antidote: None reported. Section 5 - FIRE FIGHTING MEASURES General Information: As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Extinguishing Media: Do NOT use water directly on fire. Use foam, dry chemical, or carbon dioxide. Do NOT get water inside containers. Section 6 - ACCIDENTAL RELEASE MEASURES General Information: Use proper personal protective equipment as indicated in Section 8. Spills/Leaks: Vacuum or sweep up material and place into a suitable disposal container. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions. Provide ventilation. Do not get water inside containers. Section 7 - HANDLING and STORAGE Handling: Wash thoroughly after handling. Use with adequate ventilation. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Do not allow contact with water. Wash clothing before reuse. Keep from contact with moist air and steam. Storage: Store in a tightly closed container. Store protected from moisture. Store under nitrogen. Store in a cool, dry area away from incompatible substances. Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION Engineering Controls: Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low. Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166. Skin: Wear appropriate protective gloves to prevent skin exposure. Clothing: Wear appropriate protective clothing to prevent skin exposure. Respirators: A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant a respirator's use. Follow the OSHA respirator regulations found in 29CFR 1910.134 or European Standard EN 149. Always use a NIOSH or European Standard EN 149 approved respirator when necessary. Section 9 - PHYSICAL AND CHEMICAL PROPERTIES Physical State: Solid Appearance: light yellow powder Odor: Odorless pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: Not available. Freezing/Melting Point: 215 - 217 deg C Autoignition Temperature: Not available. Flash Point: 300 deg C ( 572.00 deg F) Explosion Limits, lower: 4.20 vol % Explosion Limits, upper: 16.00 vol % Decomposition Temperature: 300 deg C Solubility in water: reacts Specific Gravity/Density: Molecular Formula: C17H6O7 Molecular Weight: 322.22 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Stable under normal temperatures and pressures. May decompose on exposure to moist air or water. Conditions to Avoid: Incompatible materials, dust generation, moisture, excess heat, exposure to moist air or water. Incompatibilities with Other Materials: Strong oxidizing agents, strong acids, strong bases, moisture. Hazardous Decomposition Products: Carbon monoxide, carbon dioxide. Hazardous Polymerization: Will not occur. Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 2421-28-5 unlisted. LD50/LC50: Not available. Carcinogenicity: 3,3',4,4'-Benzophenonetetracarboxylic dianhydride - Not listed by ACGIH, IARC, NIOSH, NTP, or OSHA. See actual entry in RTECS for complete information. Section 12 - ECOLOGICAL INFORMATION Other No information available. Section 13 - DISPOSAL CONSIDERATIONS Dispose of in a manner consistent with federal, state, and local regulations. Section 14 - TRANSPORT INFORMATION IATA Not regulated as a hazardous material. IMO Not regulated as a hazardous material. RID/ADR Not regulated as a hazardous material. Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: XI Risk Phrases: R 36/37 Irritating to eyes and respiratory system. Safety Phrases: S 25 Avoid contact with eyes. WGK (Water Danger/Protection) CAS# 2421-28-5: No information available. United Kingdom Occupational Exposure Limits Canada CAS# 2421-28-5 is listed on Canada's DSL List. CAS# 2421-28-5 is not listed on Canada's Ingredient Disclosure List. Exposure Limits US FEDERAL TSCA CAS# 2421-28-5 is listed on the TSCA inventory. SECTION 16 - ADDITIONAL INFORMATION N/A

毒性和生态

生态学数据: 对水是稍微有害的，不要让未稀释或大量的产品接触地下水，水道或者污水系统，若无政府许可，勿将材料排入周围环境

安全

• 符号: GHS07
• 信号词: Warning
• 危害声明: H319-H335
• 警示性声明: P305 + P351 + P338
• 个人防护装备: dust mask type N95 (US);Eyeshields;Gloves
• 危害码 (欧洲): Xi:Irritant;
• 风险声明 (欧洲): R36/37
• 安全声明 (欧洲): 25
• 危险品运输编码: NONH for all modes of transport
• WGK德国: 1
• 海关编码: 29183000

合成路线

2479-49-4 ~10% 2421-28-5

文献：Sakakura, Akira; Ohkubo, Takuro; Yamashita, Risa; Akakura, Matsujiro; Ishihara, Kazuaki Organic Letters, 2011 , vol. 13, # 5 p. 892 - 895

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海关

海关编码	2932999099
中文概述	2932999099. 其他仅含氧杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素	品名, 成分含量, 用途
Summary	2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%