2454-39-9

• 常用中文名：2-氨基硫代苯甲酰胺
• 常用英文名：2-Aminothiobenzamide
• CAS号：2454-39-9
• 分子式：C₇H₈N₂S
• 分子量：152.21700
• 发布时间：2018-07-18 18:33:07
• 更新时间：2024-01-06 23:31:46
• 下载msds

名称

• 中文名: 2-氨基硫代苯甲酰胺
• 英文名: 2-aminobenzenecarbothioamide
• 中文别名: 邻氨基苯硫酰胺
• 英文别名: 2-aminobenzenethioamide; 2-Aminothiobenzamide; 2-aminobenzene-1-carbothioamide; 2-amino-thiobenzamide; Benzamide,o-aminothio; o-Aminothiobenzamide; 2-Aminobenzthioamide; Thioanthranilamide; amino(2-aminophenyl)methane-1-thione

物化性质

• 密度: 1.286g/cm3
• 沸点: 318.8ºC at 760mmHg
• 熔点: 120ºC
• 分子式: C₇H₈N₂S
• 分子量: 152.21700
• 闪点: 146.6ºC
• 精确质量: 152.04100
• PSA: 84.13000
• LogP: 2.18450
• 外观性状: 淡黄色至黄色结晶粉末
• 蒸汽压: 0.000353mmHg at 25°C
• 折射率: 1.719
• 储存条件: 室温，避光保存，干燥密封
• 计算化学:

  1.疏水参数计算参考值（XlogP）:无

  2.氢键供体数量:2

  3.氢键受体数量:2

  4.可旋转化学键数量:1

  5.互变异构体数量:7

  6.拓扑分子极性表面积84.1

  7.重原子数量:10

  8.表面电荷:0

  9.复杂度:136

  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：未确定

  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）：120

  5. 沸点（ºC,常压）：未确定

  6. 沸点（ºC,42mmHg）：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: 2-Aminothiobenzamide 98% Material Safety Data Sheet Synonym: CAS: 2454-39-9 Section 1 - Chemical Product MSDS Name:2-Aminothiobenzamide 98% Material Safety Data Sheet Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS CAS# Chemical Name content EINECS# 2454-39-9 2-Aminothiobenzamide 98% unlisted Hazard Symbols: XN Risk Phrases: 20/21/22 36/37/38 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Harmful by inhalation, in contact with skin and if swallowed. Irritating to eyes, respiratory system and skin. Potential Health Effects Eye: Causes eye irritation. Skin: Causes skin irritation. Harmful if absorbed through the skin. Ingestion: Harmful if swallowed. May cause irritation of the digestive tract. Inhalation: Harmful if inhaled. Causes respiratory tract irritation. Chronic: Not available. 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 water for at least 15 minutes while removing contaminated clothing and shoes. Ingestion: Get medical aid. Wash mouth out with water. Inhalation: Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid. Notes to Physician: Treat symptomatically and supportively. 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 water spray, dry chemical, carbon dioxide, or chemical foam. 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: Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes. Storage: Keep refrigerated. (Store below 4C/39F.) Store in a tightly closed container. Store in a dry area. 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. Exposure Limits CAS# 2454-39-9: 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: Solid Color: Not available. Odor: Not available. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: Not available. Freezing/Melting Point: Not available. 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: C7H8N2S Molecular Weight: 152.22 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Not available. Conditions to Avoid: Incompatible materials. Incompatibilities with Other Materials: Strong oxidizing agents. Hazardous Decomposition Products: Nitrogen oxides, carbon monoxide, oxides of sulfur, carbon dioxide. Hazardous Polymerization: Not available. Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 2454-39-9 unlisted. LD50/LC50: Not available. Carcinogenicity: 2-Aminothiobenzamide - Not listed by ACGIH, IARC, or NTP. 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: III IMO Shipping Name: TOXIC SOLID, ORGANIC, N.O.S. Hazard Class: 6.1 UN Number: 2811 Packing Group: III RID/ADR Shipping Name: TOXIC SOLID, ORGANIC, N.O.S. Hazard Class: 6.1 UN Number: 2811 Packing group: III Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: XN Risk Phrases: R 20/21/22 Harmful by inhalation, in contact with skin and if swallowed. R 36/37/38 Irritating to eyes, respiratory system and skin. Safety Phrases: S 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 Wear suitable protective clothing, gloves and eye/face protection. WGK (Water Danger/Protection) CAS# 2454-39-9: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 2454-39-9 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 2454-39-9 is not listed on the TSCA inventory. It is for research and development use only. SECTION 16 - ADDITIONAL INFORMATION N/A

安全

• 危害码 (欧洲): Xn
• 风险声明 (欧洲): 36/37/38
• 安全声明 (欧洲): 26-36/37/39
• 海关编码: 2930909090

合成路线

28144-70-9 ~72% 2454-39-9

文献：Fontrodona; Diaz; Linden; Villalgordo Synthesis, 2001 , # 13 p. 2021 - 2027

1885-29-6 ~46% 2454-39-9

文献：Shiau; Chern; Tien; Liu Journal of Heterocyclic Chemistry, 1989 , vol. 26, # 3 p. 595 - 596

100698-06-4 ~56% 2454-39-9

文献：Acheson, R. Morrin; Lines, Claire T.; Bryce, Martin R.; Dauter, Zbigniew; Reynolds, Colin D.; Schmidpeter, Alfred Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1985 , p. 1913 - 1918

100698-06-4 ~% 28144-70-9 2454-39-9

文献：Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), , p. 1913 - 1918

612-24-8 ~% 2454-39-9

文献：Chemische Berichte, , vol. 42, p. 3712

100698-05-3 ~% 2454-39-9

文献：Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), , p. 1913 - 1918

7783-06-4 7664-41-7 1885-29-6 ~% 2454-39-9

文献：Chemische Berichte, , vol. 42, p. 3712

上下游产品

上游产品  7
28144-70-9 1885-29-6 100698-06-4 612-24-8
100698-05-3 7783-06-4 7664-41-7
下游产品  7
2536-88-1 3337-86-8 28144-70-9 59525-06-3
59525-07-4 59525-08-5 59525-09-6

海关

海关编码	2930909090
中文概述	2930909090. 其他有机硫化合物. 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:30.0%
申报要素	品名, 成分含量, 用途
Summary	2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%