3-Isoxazolemethanol,5-methyl-
			
			
				 
- 中文别名: 3-羟甲基-5-甲基异恶唑
 
- 中文释义:(5-甲基异恶唑-3-基)甲醇;3-羟甲基-5-甲基异恶唑
 
- 英文别名:(5-methyl-1,2-oxazol-3-yl)methanol;
(5-METHYL-3-ISOXAZOLYL)METHANOL;
3-hydroxymethyl-5-methylisoxazole;
5-methyl-3-isoxazolemethanol;
(5-methyl-isoxazol-3-yl)-methanol;
(5-Methyl-isoxazol-3-yl)-methanol;
5-Methylisoxazol-3-methanol;
(5-Methylisoxazol-3-yl)methanol;
(5-methyl-3-isoxazolyl)methanol;
5-methylisoxazole-3-methanol;
3-Hydroxymethyl-5-Methylisoxazole  
- CAS No.:35166-33-7
 
- 分子式:C5H7NO2
 
- 分子量:113.12
 
- 精确分子量:113.04800
 
- PSA:46.26000
 
- InChI:InChI=1/C5H7NO2/c1-4-2-5(3-7)6-8-4/h2,7H,3H2,1H3
 
- 分子结构式:
				  
			 
			物化性质
- 密度:
 - 1.183g/cm3
 - 沸点:
 - 64ºC (0.2 mmHg)
 - 闪点:
 - 102.6ºC
 - 折射率:
 - 1.496
 
 
			安全信息
- 密度:
 - 1.183g/cm3
 - 沸点:
 - 64ºC (0.2 mmHg)
 - 闪点:
 - 102.6ºC
 - 折射率:
 - 1.496
 
 
			
			MSDS
|  Name:  |  (5-Methylisoxazol-3-yl)methanol tech Material Safety Data Sheet  | 
|  Synonym:  |  3-Hydroxymethyl-5-methylisoxazol  | 
|  CAS:  |  35166-33-7  | 
  Section 1 - Chemical Product    MSDS Name:(5-Methylisoxazol-3-yl)methanol tech Material Safety Data Sheet 
 Synonym:3-Hydroxymethyl-5-methylisoxazol 
   Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
 |  CAS#  |  Chemical Name  |  content  |  EINECS#  | 
|  35166-33-7  |  (5-Methylisoxazol-3-yl)methanol  |   |  unlisted  | 
 Hazard Symbols: None Listed. 
 Risk Phrases: None Listed. 
   Section 3 - HAZARDS IDENTIFICATION
    EMERGENCY OVERVIEW
 Not available.
 Potential Health Effects
 Eye:
 May cause eye irritation.
 Skin:
 May cause skin irritation. May be harmful if absorbed through the skin.
 Ingestion:
 May cause irritation of the digestive tract. May be harmful if swallowed.
 Inhalation:
 May cause 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.
 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:
 Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable 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:
 Use adequate ventilation to keep airborne concentrations low.
 Exposure Limits CAS# 35166-33-7: 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: Liquid
 Color: pale yellow
 Odor: Not available.
 pH: Not available.
 Vapor Pressure: Not available.
 Viscosity: Not available.
 Boiling Point: 78 - 80 deg C @0.5mmHg
 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: C5H7NO2
 Molecular Weight: 113
   Section 10 - STABILITY AND REACTIVITY
    Chemical Stability:
 Not available.
 Conditions to Avoid:
 Incompatible materials.
 Incompatibilities with Other Materials:
 Oxidizing agents, bases, acid chlorides.
 Hazardous Decomposition Products:
 Hydrogen cyanide, nitrogen oxides, carbon monoxide, carbon dioxide.
 Hazardous Polymerization: Has not been reported 
   Section 11 - TOXICOLOGICAL INFORMATION
    RTECS#:
 CAS# 35166-33-7 unlisted.
 LD50/LC50:
 Not available.
 Carcinogenicity:
 (5-Methylisoxazol-3-yl)methanol - 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: Not available.
 Risk Phrases:
 Safety Phrases:
 S 24/25 Avoid contact with skin and eyes.
 WGK (Water Danger/Protection)
 CAS# 35166-33-7: No information available.
 Canada
 None of the chemicals in this product are listed on the DSL/NDSL list.
 CAS# 35166-33-7 is not listed on Canada's Ingredient Disclosure List.
 US FEDERAL
 TSCA
 CAS# 35166-33-7 is not listed on the TSCA inventory.
 It is for research and development use only.
 
 SECTION 16 - ADDITIONAL INFORMATION 
N/A
   
 
			海关数据
中国海关编码:2934999090
- 概述:
 - 2934999090. 其他杂环化合物. 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
 - 摘要/Summary:
 - 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
 
 
			分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):-0.1
2.氢键供体数量:1
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:无
6.拓扑分子极性表面积:46.3
7.重原子数量:8
8.表面电荷:0
9.复杂度:76.8
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