1H-Imidazole-5-methanol,hydrochloride (1:1)
- 中文别名:4-羟甲基咪唑盐酸盐
- 中文释义:4(5)-羟甲基咪唑盐酸盐;4-羟甲基咪唑盐酸盐;4(5)-(羟基甲基)咪唑盐酸盐;4-羟基甲基咪唑盐酸盐;4-咪唑甲醇盐酸盐
- 英文别名:1H-imidazol-5-ylmethanol,hydrochloride;
4-(HYDROXYMETHYL)IMIDAZOLE HCL;
4(5)-Hydroxymethylimidazole hydrochloride;
1H-imidazole-4-methanol hydrochloride;
1h-imidazol-4-ylmethanol hydrochloride(1:1);
4-(Hydroxymethyl)imidazole hydrochloride;
4(5)-Hydroxymethylimidazole Hydrochloride;
chlorhydrate du 4-(hydroxymethyl)imidazole;
(1H-Imidazol-4-yl)methanol hydrochloride;
4(5)-Hydroxymethyl-imidazol-hydrochlorid;
Imidazol-4-ylmethanol hydrochloride;
4-Imidazolemethanol hydrochloride;
4-Hydroxymethylimidazole hydrochloride
- CAS No.:32673-41-9
- 分子式:
C4H6N2O.ClH
- 分子量:134.56
- 精确分子量:134.02500
- PSA:48.91000
- MDL:MFCD00012697
- InChI:InChI=1/C4H6N2O.ClH/c7-2-4-1-5-3-6-4;/h1,3,7H,2H2,(H,5,6);1H
- 分子结构式:
物化性质
- 外观与性状:
- 白色至灰白色结晶粉末
- 密度:
- 1.311g/cm3
- 熔点:
- 110 °C
- 沸点:
- 393.7ºC at 760mmHg
- 闪点:
- 191.9ºC
- 存储条件/存储方法:
密封、在 -20ºC下保存
- 稳定性相关:
如果遵照规格使用和储存则不会分解,未有已知危险反应
避免氧化物
- 其它信息:
1. 性状:白色或奶油色的晶体粉末
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):108-111
5. 沸点(ºC,常压):未确定
6. 沸点(ºC,KPa):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(Pa,20ºC):未确定
12. 饱和蒸气压(KPa,20ºC):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
安全信息
- 外观与性状:
- 白色至灰白色结晶粉末
- 密度:
- 1.311g/cm3
- 熔点:
- 110 °C
- 沸点:
- 393.7ºC at 760mmHg
- 闪点:
- 191.9ºC
- 存储条件/存储方法:
密封、在 -20ºC下保存
- 稳定性相关:
如果遵照规格使用和储存则不会分解,未有已知危险反应
避免氧化物
- 其它信息:
1. 性状:白色或奶油色的晶体粉末
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):108-111
5. 沸点(ºC,常压):未确定
6. 沸点(ºC,KPa):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(Pa,20ºC):未确定
12. 饱和蒸气压(KPa,20ºC):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
毒理性
- 生态数据:
通常对水是稍微有危害的,若无政府许可,勿将材料排入周围环境
MSDS
Name: | 4-(Hydroxymethyl)imidazole hydrochloride 99% Material Safety Data Sheet |
Synonym: | 1H-Imidazol-4-ylmethanol hydrochloride |
CAS: | 32673-41-9 |
Section 1 - Chemical Product MSDS Name:4-(Hydroxymethyl)imidazole hydrochloride 99% Material Safety Data Sheet
Synonym:1H-Imidazol-4-ylmethanol hydrochloride
Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# | Chemical Name | content | EINECS# |
32673-41-9 | 4-(Hydroxymethyl)imidazole hydrochlori | 99% | 251-150-0 |
Hazard Symbols: XI
Risk Phrases: 36/37/38
Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.Hygroscopic (absorbs moisture from the air).
Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis.
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. Can produce delayed pulmonary edema.
Chronic:
No information found.
Section 4 - FIRST AID MEASURES
Eyes: Immediately 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. 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. Do NOT use mouth-to-mouth resuscitation.
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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.
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. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions.
Provide ventilation.
Section 7 - HANDLING and STORAGE
Handling:
Minimize dust generation and accumulation. Avoid breathing dust, vapor, mist, or gas. Avoid contact with eyes, skin, and clothing.
Keep container tightly closed. Avoid ingestion and inhalation. Use with adequate ventilation. Wash clothing before reuse.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Store protected from moisture.
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# 32673-41-9: 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:
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: Crystalline powder
Color: white to off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 108-111 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: C4H6N2O.HCl
Molecular Weight: 134.57
Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions. Hygroscopic: absorbs moisture or water from the air.
Conditions to Avoid:
Dust generation, exposure to moist air or water.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported
Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 32673-41-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
4-(Hydroxymethyl)imidazole 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
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
IMO
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
RID/ADR
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing group:
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 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 32673-41-9: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 32673-41-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 32673-41-9 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:2933290090
- 概述:
- 2933290090. 其他结构含非稠合咪唑环的化合物. 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
- 摘要/Summary:
- 2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. 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):无
2.氢键供体数量:3
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48.9
7.重原子数量:8
8.表面电荷:0
9.复杂度:57.7
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:2