3407-93-0

• 常用中文名：9-肼基吖啶
• 常用英文名：9-Hydrazinoacridine
• CAS号：3407-93-0
• 分子式：C₁₃H₁₁N₃
• 分子量：209.24700
• 发布时间：2018-03-20 08:00:00
• 更新时间：2024-01-08 21:57:48

• 用作有机合成中间体。

名称

• 中文名: 9-肼基吖啶
• 英文名: acridin-9-ylhydrazine
• 英文别名: ACRIDINE,9-HYDRAZINO; p-Hydrazinoacridine; 9-idrazinoacridina; acridin-9-yl hydrazine; acridine-9-ylhydrazine; Acridine,9-hydrazinyl; 9-hydrazino-acridine

物化性质

• 密度: 1.328g/cm3
• 沸点: 475.9ºC at 760mmHg
• 熔点: 177ºC
• 分子式: C₁₃H₁₁N₃
• 分子量: 209.24700
• 闪点: 241.6ºC
• 精确质量: 209.09500
• PSA: 50.94000
• LogP: 3.44690
• 外观性状: 橙色至棕色晶体或结晶粉末
• 储存条件:

  密封储存，储存于阴凉、干燥的库房。冷藏温度为-20 ºC。

• 稳定性: 常温常压下稳定，避免与不相容材料，水分接触。 与强氧化剂反应。
• 计算化学:

  1.疏水参数计算参考值（XlogP）:2.8

  2.氢键供体数量:2

  3.氢键受体数量:3

  4.可旋转化学键数量:1

  5.互变异构体数量:2

  6.拓扑分子极性表面积50.9

  7.重原子数量:16

  8.表面电荷:0

  9.复杂度:221

  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：黄色或棕色醋酸气味的固体

  2. 密度（g/mL,25℃）：未确定

  3. 相对蒸汽密度（g/mL,空气=1）：未确定

  4. 熔点（ºC）：177

  5. 沸点（ºC,常压）：未确定

  6. 沸点（ºC,12mmHg）：未确定

  7. 折射率(n20/D)：未确定

  8. 闪点（ºC）：未确定

  9. 比旋光度（º）：未确定

  10. 自燃点或引燃温度（ºC）：未确定

  11. 蒸气压（mPa,20ºC）：未确定

  12. 饱和蒸气压（kPa,25ºC）：未确定

  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）：未确定

  18. 爆炸下限（%,V/V）：未确定

  19. 溶解性：未确定

MSDS

Name: 9-Hydrazinoacridine hydrochloride 98% Material Safety Data Sheet Synonym: CAS: 3407-93-0 Section 1 - Chemical Product MSDS Name:9-Hydrazinoacridine hydrochloride 98% Material Safety Data Sheet Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS CAS# Chemical Name content EINECS# 3407-93-0 9-Hydrazinoacridine hydrochloride 98% unlisted Hazard Symbols: T+ Risk Phrases: 23/24 28 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Toxic by inhalation and in contact with skin. Very toxic if swallowed. Potential Health Effects Eye: May cause eye irritation. Skin: May cause skin irritation. Toxic in contact with skin. Ingestion: May be fatal if swallowed. May cause irritation of the digestive tract. Inhalation: May cause respiratory tract irritation. Toxic if inhaled. Chronic: Not available. Section 4 - FIRST AID MEASURES Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately. Skin: Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Ingestion: Get medical aid immediately. Wash mouth out with water. Inhalation: Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Notes to Physician: 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. Extinguishing Media: Use agent most appropriate to extinguish fire. 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. Section 7 - HANDLING and STORAGE Handling: Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Use only in a chemical fume hood. Storage: Store in a cool, dry place. Store in a tightly closed container. Deep freeze (below -20C). Poison room locked. Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION Engineering Controls: Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 3407-93-0: Personal Protective Equipment Eyes: Not available. Skin: Wear appropriate protective gloves to prevent skin exposure. Clothing: Wear appropriate protective clothing to prevent skin exposure. Respirators: Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced. Section 9 - PHYSICAL AND CHEMICAL PROPERTIES Physical State: Crystalline powder Color: ochre Odor: acetic odor pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: Not available. Freezing/Melting Point: 301-305 deg C Autoignition Temperature: Not available. Flash Point: Not available. Explosion Limits, lower: Not available. Explosion Limits, upper: Not available. Decomposition Temperature: Solubility in water: Specific Gravity/Density: Molecular Formula: C13H11N3.HCl Molecular Weight: 245.71 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Stable under normal temperatures and pressures. Conditions to Avoid: Incompatible materials, moisture. Incompatibilities with Other Materials: Strong oxidizing agents. Hazardous Decomposition Products: Carbon monoxide, oxides of nitrogen, carbon dioxide. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 3407-93-0: AR9321500 LD50/LC50: Not available. Carcinogenicity: 9-Hydrazinoacridine hydrochloride - Not listed by ACGIH, IARC, or NTP. Other: See actual entry in RTECS for complete information. Section 12 - ECOLOGICAL INFORMATION Section 13 - DISPOSAL CONSIDERATIONS Dispose of in a manner consistent with federal, state, and local regulations. Section 14 - TRANSPORT INFORMATION IATA Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.* Hazard Class: 6.1 UN Number: 2811 Packing Group: I IMO Shipping Name: TOXIC SOLID, ORGANIC, N.O.S. Hazard Class: 6.1 UN Number: 2811 Packing Group: I RID/ADR No information available. Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: T+ Risk Phrases: R 23/24 Toxic by inhalation and in contact with skin. R 28 Very toxic if swallowed. Safety Phrases: S 1 Keep locked up. S 28A After contact with skin, wash immediately with plenty of water. S 36/37/39 Wear suitable protective clothing, gloves and eye/face protection. S 38 In case of insufficient ventilation, wear suitable respiratory equipment. S 45 In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible). WGK (Water Danger/Protection) CAS# 3407-93-0: No information available. Canada CAS# 3407-93-0 is listed on Canada's NDSL List. CAS# 3407-93-0 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 3407-93-0 is listed on the TSCA inventory. SECTION 16 - ADDITIONAL INFORMATION N/A

毒性和生态

毒理学数据: 1、急性毒性：大鼠LD50：12mg/kg； CHEMICAL IDENTIFICATION RTECS NUMBER : AR9321500 CHEMICAL NAME : Acridine, 9-hydrazino- CAS REGISTRY NUMBER : 3407-93-0 BEILSTEIN REFERENCE NO. : 0172911 LAST UPDATED : 199710 DATA ITEMS CITED : 3 MOLECULAR FORMULA : C13-H11-N3 MOLECULAR WEIGHT : 209.27 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 12 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : FRZKAP Farmatsevtichnii Zhurnal (Kiev). (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.3- 1930- Volume(issue)/page/year: (4),40,1984

安全

• 危害码 (欧洲): T+: Very toxic;Xi: Irritant;
• 风险声明 (欧洲): R28
• 安全声明 (欧洲): 45-36/37/39-28A-1
• 海关编码: 2933990090

合成路线

1207-69-8 ~85% 3407-93-0

文献：Chandra, Trilok; Garg, Neha; Lata, Suman; Saxena; Kumar, Ashok European Journal of Medicinal Chemistry, 2010 , vol. 45, # 5 p. 1772 - 1776

上下游产品

上游产品  1
1207-69-8
下游产品  2
91627-28-0 91627-29-1

制备

用9-氯代吖啶在铂及少量碱存在下与肼加热制得。

海关

海关编码	2933990090
中文概述	2933990090. 其他仅含氮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, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%