中文名 | 2-氨基-6,7-二甲基-4-羟基他啶水合物 |
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英文名 | 2-amino-6,7-dimethyl-4-hydroxypteridine |
中文别名 | 2-氨基-6,7-二甲基-4-羟基蝶啶 |
英文别名 |
MFCD00006706
2-amino-6,7-dimethyl-1H-pteridin-4-one EINECS 210-270-3 |
密度 | 1.65g/cm3 |
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沸点 | 423.9ºC at 760 mmHg |
熔点 | >300 °C(lit.) |
分子式 | C8H9N5O |
分子量 | 191.19000 |
闪点 | 210.1ºC |
精确质量 | 191.08100 |
PSA | 97.81000 |
LogP | 0.90560 |
折射率 | 1.79 |
储存条件 | 贮存: 将密器密封,储存密封的主藏器内,并放在阴凉, 干爽的位置。 |
稳定性 | 性质与稳定性: 常温常压下,或不分解产物。 |
分子结构 | 五、分子性质数据: 1、 摩尔折射率:52.22 2、 摩尔体积(m3/mol):129.7 3、 等张比容(90.2K):403.8 4、 表面张力(dyne/cm):93.9 5、 极化率(10 -24cm 3):20.70 |
计算化学 | 1.疏水参数计算参考值(XlogP):-0.6 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:0 5.互变异构体数量:55 6.拓扑分子极性表面积93.3 7.重原子数量:14 8.表面电荷:0 9.复杂度:290 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 |
Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
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# 611-55-2: 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: > 300 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: C8H9N5O Molecular Weight: 191.19 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, carbon dioxide. Hazardous Polymerization: Not available. Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 611-55-2 unlisted. LD50/LC50: Not available. Carcinogenicity: 2-Amino-6,7-dimethyl-4-pteridinol - 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# 611-55-2: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 611-55-2 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 611-55-2 is not listed on the TSCA inventory. It is for research and development use only. SECTION 16 - ADDITIONAL INFORMATION N/A |
生态学数据: 三、生态学数据: 1、其它有害作用:该物质对环境可能有危害,对水体应给予特别注意。
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危害码 (欧洲) | Xi:Irritant; |
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风险声明 (欧洲) | 36/37/38 |
安全声明 (欧洲) | S26-S36 |
WGK德国 | 3 |
海关编码 | 2933990090 |
上游产品 9 | |
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下游产品 0 |
海关编码 | 2933990090 |
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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% |