2-Chloro-5-chloromethylpyridine
- 中文别名：2-氯-5-氯甲基吡啶
- 中文释义：2-氯-5-氯甲基吡啶;2-氯-5-(氯甲基)吡啶;二氯五氯甲基吡啶;2,5-二氯甲基吡啶
- 英文别名：2-Chloro-5-chloromethylpyridine;
2-chloropyridyl-5-methylene chloride;
2-Chloro-5-pyridylMethyl chloride;
5-chloromethyl-2-chloropyridine;
6-Chlo;
imidacloprid impurity;
2,5-DICHLORO-4-METHYL-PYRIDINE;
2-Chloro-5-Chloro-Me;
AURORA KA-6694;
2-chloro-5-chloromethyl-pyridine;
2-Chlor-5-Chlormethylpyridine;
6-chloro-nicotinyl chloride
- CAS No.：70258-18-3
- 分子式：
C6H5Cl2N
- 分子量：162.02
- 精确分子量：160.98000
- PSA：12.89000
- MDL：MFCD00125366
- InChI：InChI=1/C6H5Cl2N/c1-4-2-6(8)9-3-5(4)7/h2-3H,1H3
- 分子结构式：
物化性质
- 外观与性状：
- 米色晶体
- 密度：
- 1.324 g/cm3
- 熔点：
- 37-42 °C(lit.)
- 沸点：
- 249.8ºC at 760 mmHg
- 闪点：
- >230 °F
- 折射率：
- 1.547
- 存储条件/存储方法：
存放在密封容器内，并放在阴凉，干燥处。储存的地方必须上锁，钥匙必须交给技术专家和他们的助手保管。储存的地方必须远离氧化剂。
- 稳定性相关：
远离氧化物。
- 其它信息：
1. 性状：白色结晶
2. 密度（g/mL,25/4℃）：未确定
3. 相对蒸汽密度（g/mL,空气=1）：未确定
4. 熔点（ºC）：35~36
5. 沸点（ºC,常压）：未确定
6. 沸点（ºC,400Pa）：88~90
7. 折射率：未确定
8. 闪点（ºC）：＞110
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（kPa,25ºC）：未确定
12. 饱和蒸气压（kPa,60ºC）：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：工业品为橘红色黏稠状液体，有刺激性气味，溶于多种有机溶剂和有机酸等。
安全信息
- 外观与性状：
- 米色晶体
- 密度：
- 1.324 g/cm3
- 熔点：
- 37-42 °C(lit.)
- 沸点：
- 249.8ºC at 760 mmHg
- 闪点：
- >230 °F
- 折射率：
- 1.547
- 存储条件/存储方法：
存放在密封容器内，并放在阴凉，干燥处。储存的地方必须上锁，钥匙必须交给技术专家和他们的助手保管。储存的地方必须远离氧化剂。
- 稳定性相关：
远离氧化物。
- 其它信息：
1. 性状：白色结晶
2. 密度（g/mL,25/4℃）：未确定
3. 相对蒸汽密度（g/mL,空气=1）：未确定
4. 熔点（ºC）：35~36
5. 沸点（ºC,常压）：未确定
6. 沸点（ºC,400Pa）：88~90
7. 折射率：未确定
8. 闪点（ºC）：＞110
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（kPa,25ºC）：未确定
12. 饱和蒸气压（kPa,60ºC）：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：工业品为橘红色黏稠状液体，有刺激性气味，溶于多种有机溶剂和有机酸等。
毒理性
- 毒理学数据：
强刺激性，避免与皮肤接触。
- 生态数据：
对水稍微有危害的，不要让未稀释或者大量产品接触地下水，水道或者污水系统。若无政府许可，勿将材料排入周围环境。
MSDS
| Name: | 2-Chloro-5-chloromethylpyridine tech. 90% Material Safety Data Sheet |
| Synonym: | |
| CAS: | 70258-18-3 |
Section 1 - Chemical Product MSDS Name:2-Chloro-5-chloromethylpyridine tech. 90% Material Safety Data Sheet
Synonym:
Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
| CAS# | Chemical Name | content | EINECS# |
| 70258-18-3 | 2-Chloro-5-chloromethylpyridine | 90 | unlisted |
Hazard Symbols: C
Risk Phrases: 34
Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Causes burns.
Potential Health Effects
Eye:
Causes eye burns.
Skin:
Causes skin burns.
Ingestion:
Causes gastrointestinal tract burns.
Inhalation:
Causes chemical burns to the respiratory tract.
Chronic:
No information found.
Section 4 - FIRST AID MEASURES
Eyes: In case of contact, immediately flush eyes with plenty of water for at least 15 minutes. Get medical aid immediately.
Skin:
In case of contact, immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Get medical aid immediately. Wash clothing before reuse.
Ingestion:
If swallowed, do NOT induce vomiting. Get medical aid immediately.
If victim is fully conscious, give a cupful of water. Never give anything by mouth to an unconscious person.
Inhalation:
If inhaled, remove to fresh air. 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. Avoid generating dusty conditions. Provide ventilation.
Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Do not get in eyes, on skin, or on clothing. Do not breathe dust. Use only with adequate ventilation.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Corrosives area.
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# 70258-18-3: 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: Crystals
Color: beige
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 37-42 deg C
Autoignition Temperature: Not available.
Flash Point: > 230 deg F (> 110.00 deg C)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C6H5Cl2N
Molecular Weight: 161.9477
Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
High temperatures, dust generation.
Incompatibilities with Other Materials:
Strong oxidizing agents, acids, acid chlorides, acid anhydrides.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, oxides of nitrogen, carbon dioxide.
Hazardous Polymerization: Has not been reported
Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 70258-18-3 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-Chloro-5-chloromethylpyridine - 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: Corrosive Solid, Acidic, Organic, N.O.S.
Hazard Class: 8
UN Number: 3261
Packing Group: III
IMO
Shipping Name: Corrosive Solid, Acidic, Organic, N.O.S.
Hazard Class: 8
UN Number: 3261
Packing Group: III
RID/ADR
Shipping Name: Corrosive Solid, Acidic, Organic, N.O.S.
Hazard Class: 8
UN Number: 3261
Packing group:
Section 15 - REGULATORY INFORMATION
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 34 Causes burns.
Safety Phrases:
S 25 Avoid contact with eyes.
S 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 70258-18-3: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 70258-18-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 70258-18-3 is not listed on the TSCA inventory.
It is for research and development use only.
SECTION 16 - ADDITIONAL INFORMATION
N/A
分子结构与计算化学数据
分子结构数据
1、 摩尔折射率：39.00
2、 摩尔体积（cm3/mol）：122.3
3、 等张比容（90.2K）：312.5
4、 表面张力（dyne/cm）：42.6
5、 极化率（10-24cm3）：15.46
计算化学数据
1.疏水参数计算参考值（XlogP）:2.2
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:1
5.互变异构体数量:无
6.拓扑分子极性表面积12.9
7.重原子数量:9
8.表面电荷:0
9.复杂度:87.1
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
