17846-15-0

• 常用中文名：金刚烷-1-羧肼
• 常用英文名：adamantane-1-carbohydrazide
• CAS号：17846-15-0
• 分子式：C₁₁H₁₈N₂O
• 分子量：194.273
• 发布时间：2018-05-08 08:00:00
• 更新时间：2024-01-09 18:41:55

名称

• 中文名: 金刚烷-1-羧肼
• 英文名: adamantane-1-carbohydrazide
• 中文别名: 金刚烷-1-甲酰肼
• 英文别名: Tricyclo[3.3.1.1]decane-1-carboxylic acid, hydrazide; admantane-1-carbohydrazide; 1-adamantanecarboxylic acid hydrazide; 1-adamantanecarbohydrazide; tricyclo[3.3.1.1~3,7~]decane-1-carbohydrazide; F0020-1578; (3s,5s,7s)-1-Adamantanecarbohydrazide; adamantane-1-carboxylic acid hydrazide; adamantanecarbohydrazide; adamantyl-1-carbohydrazide

物化性质

• 密度: 1.2±0.1 g/cm3
• 沸点: 370.8±9.0 °C at 760 mmHg
• 熔点: 151ºC
• 分子式: C₁₁H₁₈N₂O
• 分子量: 194.273
• 闪点: 178.0±18.7 °C
• 精确质量: 194.141907
• PSA: 55.12000
• LogP: 1.25
• 蒸汽压: 0.0±0.8 mmHg at 25°C
• 折射率: 1.581
• 计算化学:

  1.疏水参数计算参考值（XlogP）:1.4

  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:2

  6.拓扑分子极性表面积:55.1

  7.重原子数量:14

  8.表面电荷:0

  9.复杂度:233

  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

MSDS

Name: Adamantane-1-carbohydrazide 97% Material Safety Data Sheet Synonym: CAS: 17846-15-0 Section 1 - Chemical Product MSDS Name:Adamantane-1-carbohydrazide 97% Material Safety Data Sheet Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS CAS# Chemical Name content EINECS# 17846-15-0 Adamantane-1-carbohydrazide 97% unlisted Hazard Symbols: XI Risk Phrases: 36/37/38 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Irritating to eyes, respiratory system and skin. Potential Health Effects Eye: Causes eye irritation. Skin: Causes skin irritation. May be harmful if absorbed through the skin. Ingestion: May cause irritation of the digestive tract. May be harmful if swallowed. Inhalation: Causes respiratory tract irritation. May be harmful if inhaled. 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: Store in a cool, dry place. Store in a tightly closed container. 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# 17846-15-0: 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: Solid Color: beige Odor: Not available. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: Not available. Freezing/Melting Point: 157 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: C11H18N2O Molecular Weight: 194 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Not available. Conditions to Avoid: Incompatible materials. Incompatibilities with Other Materials: Strong oxidizing agents, acids, acid chlorides. Hazardous Decomposition Products: Carbon monoxide, oxides of nitrogen, carbon dioxide. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 17846-15-0 unlisted. LD50/LC50: Not available. Carcinogenicity: Adamantane-1-carbohydrazide - 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 No information available. IMO No information available. RID/ADR No information available. Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: XI Risk Phrases: 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 37/39 Wear suitable gloves and eye/face protection. WGK (Water Danger/Protection) CAS# 17846-15-0: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 17846-15-0 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 17846-15-0 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): Xi:Irritant;
• 风险声明 (欧洲): R36/37/38
• 安全声明 (欧洲): S26-S37/39
• 海关编码: 2928000090

合成路线

896109-93-6 ~23% 496938-13-7 17846-15-0 108-26-9

文献：Russian Journal of Organic Chemistry, , vol. 44, # 12 p. 1760 - 1764

711-01-3 ~% 17846-15-0

文献：Molecules, , vol. 15, # 4 p. 2526 - 2550

2094-73-7 ~% 17846-15-0

文献：Chemische Berichte, , vol. 93, p. 1161 - 1166

828-51-3 ~% 17846-15-0

文献：European Journal of Medicinal Chemistry, , vol. 68, p. 96 - 102

上下游产品

上游产品  3
711-01-3 2094-73-7 828-51-3
下游产品  5
2094-74-8 345987-96-4 139158-25-1 26526-57-8
67889-03-6

海关

海关编码	2928000090
中文概述	2928000090 其他肼（联氨）及胲（羟胺）的有机衍生物。监管条件:无。增值税率:17.0%。退税率:9.0%。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	2928000090 other organic derivatives of hydrazine or of hydroxylamine VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%