1H-Imidazolium,1,3-bis(4-chlorophenyl)-, chloride (1:1)
- 中文别名:1,3-Bis(4-chlorophenyl)imidazolium chloride
- 中文释义:1,3-双(4-氯苯基)咪唑氯化物;1,3-双(4-氯苯基)-1H-咪唑氯化物
- 英文别名:1,3-bis(4-chlorophenyl)imidazol-1-ium,chloride;
pCl IMD salt
- CAS No.:141556-46-9
- 分子式:
C15H11Cl2N2.Cl
- 分子量:325.62
- 精确分子量:323.99900
- PSA:8.81000
- InChI:The Key: SANZEZUASUDVTC-UHFFFAOYSA-M
- 分子结构式:
物化性质
- 熔点:
- 251-252ºC
- 存储条件/存储方法:
密闭于阴凉干燥环境中
- 稳定性相关:
遵照规定使用和储存则不会分解。
- 其它信息:
1. 性状:无可用
2. 密度(g/mL,25/4℃):无可用
3. 相对蒸汽密度(g/mL,空气=1):无可用
4. 熔点(ºC):251-252
5. 沸点(ºC,常压):无可用
6. 沸点(ºC,5.2kPa):无可用
7. 折射率:无可用
8. 闪点(ºC):无可用
9. 比旋光度(º):无可用
10. 自燃点或引燃温度(ºC):无可用
11. 蒸气压(kPa,25ºC):无可用
12. 饱和蒸气压(kPa,60ºC):无可用
13. 燃烧热(KJ/mol):无可用
14. 临界温度(ºC):无可用
15. 临界压力(KPa):无可用
16. 油水(辛醇/水)分配系数的对数值:无可用
17. 爆炸上限(%,V/V):无可用
18. 爆炸下限(%,V/V):无可用
19. 溶解性:无可用
安全信息
- 熔点:
- 251-252ºC
- 存储条件/存储方法:
密闭于阴凉干燥环境中
- 稳定性相关:
遵照规定使用和储存则不会分解。
- 其它信息:
1. 性状:无可用
2. 密度(g/mL,25/4℃):无可用
3. 相对蒸汽密度(g/mL,空气=1):无可用
4. 熔点(ºC):251-252
5. 沸点(ºC,常压):无可用
6. 沸点(ºC,5.2kPa):无可用
7. 折射率:无可用
8. 闪点(ºC):无可用
9. 比旋光度(º):无可用
10. 自燃点或引燃温度(ºC):无可用
11. 蒸气压(kPa,25ºC):无可用
12. 饱和蒸气压(kPa,60ºC):无可用
13. 燃烧热(KJ/mol):无可用
14. 临界温度(ºC):无可用
15. 临界压力(KPa):无可用
16. 油水(辛醇/水)分配系数的对数值:无可用
17. 爆炸上限(%,V/V):无可用
18. 爆炸下限(%,V/V):无可用
19. 溶解性:无可用
毒理性
- 生态数据:
通常对水是不危害的,若无政府许可,勿将材料排入周围环境。
MSDS
Section 1: Product Identification
Chemical Name:1,3-Bis(4-chlorophenyl)imidazolium chloride, min. 97%
CAS Registry Number:141556-46-9
Formula:[C15H11Cl2N2]Cl
EINECS Number:None
Chemical Family:organic amine
Synonym:1,3-di-(4-chlorophenyl)imidazolium chloride
Section 2: Composition and Information on Ingredients
IngredientCAS NumberPercentACGIH (TWA)OSHA (PEL)
Title Compound141556-46-9100%no datano data
Section 3: Hazards Identification
Emergency Overview:Irritiating to skin, eyes and respiratory tract. May be harmful if swallowed.
Primary Routes of Exposure:Ingestion, inhalation, skin and eyes.
Eye Contact:Irritating to the eyes.
Skin Contact:Irritating to the skin.
Inhalation:Irritating to the nose, mucous membranes and respiratory tract.
Ingestion:No information available on the physiological effects of ingestion.
Acute Health Affects:Irritating to skin, eyes and respiratory tract.
Chronic Health Affects:No information available on long-term chronic effects.
NTP:No
IARC:No
OSHA:No
SECTION 4: First Aid Measures
Immediately flush the eyes with copious amounts of water for at least 10-15 minutes. A victim may need
Eye Exposure:
assistance in keeping their eye lids open. Get immediate medical attention.
Wash the affected area with water. Remove contaminated clothes if necessary. Seek medical assistance if
Skin Exposure:
irritation persists.
Remove the victim to fresh air. Closely monitor the victim for signs of respiratory problems, such as difficulty
Inhalation:
in breathing, coughing, wheezing, or pain. In such cases seek immediate medical assistance.
Seek medical attention immediately. Keep the victim calm. Give the victim water (only if conscious). Induce
Ingestion:
vomiting only if directed by medical personnel.
SECTION 5: Fire Fighting Measures
Flash Point:no data
Autoignition Temperature:none
Explosion Limits:none
Extinguishing Medium:carbon dioxide, foam or dry powder
If this product is involved in a fire, fire fighters should be equipped with a NIOSH approved positive pressure
Special Fire Fighting Procedures:
self- contained breathing apparatus and full protective clothing.
Hazardous Combustion andIf involved in a fire this material may emit toxic fumes of nitrogen oxides and hydrogen chloride.
Decomposion Products:
Unusual Fire or Explosion Hazards: No unusual fire or explosion hazards.
SECTION 6: Accidental Release Measures
Small spills can be mixed with vermiculite, sodium carbonate or other suitable non combustible adsorbent and
Spill and Leak Procedures:
swept up.
SECTION 7: Handling and Storage
Handling and Storage:Store in a cool, dry place in a tightly sealed container.
SECTION 8: Exposure Controls and Personal Protection
Eye Protection:Always wear approved safety glasses when handling a chemical substance in the laboratory.
Skin Protection:Wear protective clothing and gloves.
Ventilation:Material may form a fine dust. If possible, handle the material in an efficient fume hood.
If ventilation is not available a respirator should be worn. The use of respirators requires a Respirator
Respirator:
Protection Program to be in compliance with 29 CFR 1910.134.
Ventilation:Material may form a fine dust. If possible, handle the material in an efficient fume hood.
Additional Protection:No additional protection required.
SECTION 9: Physical and Chemical Properties
Color and Form:cream-colored powder
Molecular Weight:325.62
Melting Point:251-252°C
Boiling Point:no data
Vapor Pressure:no data
Specific Gravity:no data
Odor:none
Solubility in Water:soluble
SECTION 10: Stability and Reactivity
Stability:hygroscopic
Hazardous Polymerization:no hazardous polymerization
Conditions to Avoid:exposure to moisture and strong bases.
Incompatibility:strong oxidizing agents, halogenated solvents and acidic solvents.
Decomposition Products:carbon dioxide, carbon monoxide, nitrogen oxides, and organic fumes.
SECTION 11: Toxicological Information
RTECS Data:No information available in the RTECS files.
Carcinogenic Effects:No data
Mutagenic Effects:No data
Tetratogenic Effects:No data
SECTION 12: Ecological Information
Ecological Information:No information available
SECTION 13: Disposal Considerations
Disposal:Dispose of according to local, state and federal regulations.
SECTION 14: Transportation
Shipping Name (CFR):Non-hazardous
Hazard Class (CFR):NA
Additional Hazard Class (CFR):NA
Packaging Group (CFR):NA
UN ID Number (CFR):NA
Shipping Name (IATA):Non-hazardous
Hazard Class (IATA):NA
Additional Hazard Class (IATA):NA
Packaging Group (IATA):NA
UN ID Number (IATA):NA
SECTION 15: Regulatory Information
TSCA:Not listed in the TSCA inventory.
SARA (Title 313):Title compound not listed.
Second Ingredient:None
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
分子结构数据
1、摩尔折射率:无可用
2、 摩尔体积(cm3/mol):无可用
3、 等张比容(90.2K):无可用
4、 表面张力(dyne/cm):无可用
5、 极化率:无可用
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:0
3.氢键受体数量:1
4.可旋转化学键数量:2
5.互变异构体数量:无
6.拓扑分子极性表面积8.8
7.重原子数量:20
8.表面电荷:0
9.复杂度:256
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