36518-76-0

• 常用中文名：2-氨基-4-亚氨基-2-噻唑啉盐酸盐
• 常用英文名：4-Thiazolamine,2,5-dihydro-2-imino-, hydrochloride (1:1)
• CAS号：36518-76-0
• 分子式：C₃H₆ClN₃S
• 分子量：151.61800
• 发布时间：2018-12-29 20:29:31
• 更新时间：2024-01-10 17:36:42

名称

• 中文名: 2-氨基-4-亚氨基-2-噻唑啉盐酸盐
• 英文名: 2-imino-5H-1,3-thiazol-4-amine,hydrochloride
• 中文别名: 2-氨基-4-亚氨基-2-噻唑啉
• 英文别名: 2-amino-4-imino-2-thiazoline hydrochloride; 4-iminium-4,5-dihydrothiazol-2-yl amine chloride; EINECS 253-083-2; 2-imino-5H-1,3-thiazol-4-amine Hydrochloride; 2-amino-4-thiazoliniminium chloride; MFCD00012721; 4-IMINO-4,5-2H-THIAZOL-2-YLAMINE,HYDROCHLORIDE

物化性质

• 沸点: 340ºC at 760mmHg
• 熔点: 230ºC
• 分子式: C₃H₆ClN₃S
• 分子量: 151.61800
• 闪点: 159.4ºC
• 精确质量: 150.99700
• PSA: 87.53000
• LogP: 1.06280
• 储存条件:

  密封、阴凉、干燥、通风保存

• 稳定性:

  常规情况下不会分解，没有危险反应

• 计算化学:

  1、 疏水参数计算参考值（XlogP）：未确定

  2、 氢键受体数量：3

  3、 可旋转化学键数量：3

  4、 拓扑分子极性表面积（TPSA）：64.9

  5、 重原子数量：8

  6、 表面电荷：0

  7、 复杂度67.2

  8、 同位素原子数量：0

  9、 确定原子立构中心数量：0

  10、 不确定原子立构中心数量：0

  11、 确定化学键立构中心数量：0

  12、 不确定化学键立构中心数量：0

  13、 共价键单元数量：2

• 更多:

  1. 性状：固体

  2. 密度（g/mL,20℃）：未确定

  3. 相对蒸汽密度（g/mL,空气=1）： 未确定

  4. 熔点（ºC）：>300

  5. 沸点（ºC,常压）： 未确定

  6. 沸点（ºC,50mm hg）：未确定

  7. 折射率：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（kPa,25ºC）：未确定

  12. 饱和蒸气压（kPa,60ºC）： 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-Amino-4-Imino-2-Thiazoline Hydrochloride 99% Material Safety Data Sheet Synonym: None known CAS: 36518-76-0 Section 1 - Chemical Product MSDS Name:2-Amino-4-Imino-2-Thiazoline Hydrochloride 99% Material Safety Data Sheet Synonym:None known Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS CAS# Chemical Name content EINECS# 36518-76-0 2-Amino-4-Imino-2-Thiazoline Hydrochlo 99 253-083-2 Hazard Symbols: None Listed. Risk Phrases: None Listed. Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW The toxicological properties of this material have not been fully investigated. Potential Health Effects Eye: May cause 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: May cause 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 water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Ingestion: Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or 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: 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: Use agent most appropriate to extinguish fire. Use water spray, dry chemical, carbon dioxide, or appropriate foam. Section 6 - ACCIDENTAL RELEASE MEASURES General Information: Use proper personal protective equipment as indicated in Section 8. Spills/Leaks: Clean up spills immediately, observing precautions in the Protective Equipment section. Sweep up, then place into a suitable container for disposal. Avoid generating dusty conditions. Provide ventilation. Section 7 - HANDLING and STORAGE Handling: Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Storage: Store in a tightly closed container. Store in a cool, dry, well-ventilated 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. Exposure Limits CAS# 36518-76-0: 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 respirator use. Section 9 - PHYSICAL AND CHEMICAL PROPERTIES Physical State: Powder Color: white to pale yellow Odor: None reported. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: Not available. Freezing/Melting Point: > 230 deg C Autoignition Temperature: Not applicable. Flash Point: Not applicable. Explosion Limits, lower: Not available. Explosion Limits, upper: Not available. Decomposition Temperature: Solubility in water: Specific Gravity/Density: Molecular Formula: C3H5N3S.HCl Molecular Weight: 151.62 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Stable under normal temperatures and pressures. Conditions to Avoid: Incompatible materials, dust generation, excess heat, strong oxidants. Incompatibilities with Other Materials: Oxidizing agents. Hazardous Decomposition Products: Nitrogen oxides, carbon monoxide, oxides of sulfur, irritating and toxic fumes and gases, carbon dioxide. Hazardous Polymerization: Has not been reported. Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 36518-76-0 unlisted. LD50/LC50: Not available. Carcinogenicity: 2-Amino-4-Imino-2-Thiazoline Hydrochloride - 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 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: Not available. Risk Phrases: Safety Phrases: S 24/25 Avoid contact with skin and eyes. S 28A After contact with skin, wash immediately with plenty of water. S 37 Wear suitable gloves. 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# 36518-76-0: No information available. Canada CAS# 36518-76-0 is listed on Canada's NDSL List. CAS# 36518-76-0 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 36518-76-0 is listed on the TSCA inventory. SECTION 16 - ADDITIONAL INFORMATION N/A

毒性和生态

生态学数据: 对水是稍微有危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

• 安全声明 (欧洲): S24/25
• 危险品运输编码: UN 2811
• 包装等级: III
• 危险类别: 6.1
• 海关编码: 2934100090

合成路线

107-14-2 17356-08-0 ~99% 36518-76-0

文献：Flaig, Ronald; Hartmann, Horst Heterocycles, 1997 , vol. 45, # 5 p. 875 - 888

37622-18-7 77679-09-5 ~89% 36518-76-0 121721-56-0

文献：Abdelaal, Salma; Bauer, Ludwig Journal of Heterocyclic Chemistry, 1988 , vol. 25, p. 1849 - 1856

上下游产品

上游产品  3
107-14-2 37622-18-7 77679-09-5
下游产品  1
850021-29-3

海关

海关编码	2934100090
中文概述	2934100090. 结构上含有一个非稠合噻唑环的化合物(不论是否氢化). 增值税率:17.0%. 退税率:9.0%. 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	2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%