70258-18-3 (2-氯-5-氯甲基吡啶,2-Chloro-5-(chloromethyl)pyridine)

CAS号:
70258-18-3
中文名称:
2-氯-5-氯甲基吡啶
英文名称:
2-Chloro-5-(chloromethyl)pyridine
安全信息:
分子式:
C6H5Cl2N
分子量:
162.016599416733

2-氯-5-氯甲基吡啶(70258-18-3)名称与标识符

名称

中文别名:
2-氯-5-氯甲基吡啶;2-氯-5-(氯甲基)吡啶;2,5-二氯甲基吡啶;二氯五氯甲基吡啶;2-Chloro-5-(chloromethyl)pyridine 2-氯-5-(氯甲基)吡啶;2-氯-5-甲基吡啶;2-氯-5氯甲基吡啶;2-氯-5-氯甲基吡啶 标准品;2-氯-5-氯甲基吡啶CCMP;5-氯甲基-2-氯吡啶;农药中间体;
英文别名:
2-Chloro-5-chloromethylpyridine;CCMP;AURORA KA-6694;2,5-DICHLORO-4-METHYL-PYRIDINE;AKOS MSC-0759;TIMTEC-BB SBB003948;2-Chloro-5-(chloromethyl)pyridine;2-Chlor-5-Chlormethylpyridine;2-Chloro-5-Chloro-Me;2-chloro-5-chloromethyl-pyridine;2-Chloro-5-pyridylMethyl chloride;2-chloropyridyl-5-methylene chloride;5-chloromethyl-2-chloropyridine;6-Chlo;6-chloro-nicotinyl chloride;imidacloprid impurity;Pyridine, 2-chloro-5-(chloromethyl)-;SKCNYHLTRZIINA-UHFFFAOYSA-N;PubChem9210;KSC377C3B;2-chloro-5chloromethylpyridine;2-chloro-5-chloromethypyridine;6-chloro-3-chloromethylpyridine;2-chloro-5-pyridylmethylchloride;2-chloro-5-(chlormethyl)pyridin;6-chloro-3-chloromethyl pyridine;2-chl;FT-0611802;2-chloro-5-(chloromethyl)-pyridine;F8889-1064;D77784;A9274;CS-W016127;A23964;Q-101478;70258-18-3;AM81289;MFCD00125366;W-204147;2chloro-5-(chloromethyl)-pyridine;AC-3125;6-chloro-3-pyridylmethyl chloride;A937079;6-chloro-3-(chloromethyl)pyridine;AKOS004115451;NS00077821;2-Chloro-5-(chloromethyl)pyridine, 97%;BCP22152;2-chloro-5-(chloromethyl) pyridine;EN300-26806;2-chloro-pyrid-5-ylmethyl chloride;C1628;AB03513;AS-10766;SCHEMBL17799;AN-717/25052001;InChI=1/C6H5Cl2N/c7-3-5-1-2-6(8)9-4-5/h1-2,4H,3H;2-chloro-5-chloromethyl pyridine;DTXSID50220498;STK288946;DB-013487;ALBB-016819;

标识符

MDL:
MFCD00125366
InChIKey:
SKCNYHLTRZIINA-UHFFFAOYSA-N
Inchi:
1S/C6H5Cl2N/c7-3-5-1-2-6(8)9-4-5/h1-2,4H,3H2
SMILES:
ClCC1C=NC(=CC=1)Cl
BRN:
1635690

2-氯-5-氯甲基吡啶(70258-18-3)物化性质

实验特性

  • LogP : 2.47380
  • PSA : 12.89000
  • 折射率 : 1.6000 (estimate)
  • 水溶性 : Insoluble in water.
  • 沸点 : 267.08°C (rough estimate)
  • 熔点 : 37-42 °C (lit.)
  • 闪点 : 华氏:230 °F
    摄氏:110 °C
  • 颜色与性状 : 白色结晶
  • 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。
  • 密度 : 1.4411 (rough estimate)

计算特性

  • 精确分子量 : 160.98000
  • 氢键供体数量 : 0
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 1
  • 同位素质量 : 160.98
  • 重原子数量 : 9
  • 复杂度 : 87.1
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 2.2
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 12.9

2-氯-5-氯甲基吡啶(70258-18-3)安全信息

2-氯-5-氯甲基吡啶(70258-18-3)国际标准相关数据

EINECS:
24873906

2-氯-5-氯甲基吡啶(70258-18-3)海关数据

海关编码:
2933399010
海关数据:

中国海关编码:

2933399090

概述:

2933399090. 其他结构含非稠合吡啶环的化合物. 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

Summary:

2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2-氯-5-氯甲基吡啶(70258-18-3)生产方法和用途

用途:
用作农药吡虫啉和啶虫咪中间体;2-氯-5-氯甲基吡啶是杀虫剂吡虫啉、啶虫脒的中间体。
生产方法:
2-氯-5-氯甲基吡啶的合成方法较多,目前工业上多采用2-氯-5-甲基吡啶为原料,即由2-氯-5-甲基吡啶在催化剂存在下进行支链氯化,得到2-氯-5-氯甲基吡啶。将2-氯-5-甲基吡啶和溶剂加到氯化釜中,加入催化剂,在回流条件下通入氯气进行反应,反应结束后,先常压脱溶,再转入蒸馏釜中真空脱去前馏分,从釜底得到2-氯-5-氯甲基吡啶。除此之外,还有以烟酸为原料、以3-甲基吡啶为原料、以2-氯-5-三氯甲基吡啶为原料等各种不同的路线。这些方法的一个共同点都是先形成吡啶环,然后再完成氯甲基化。而美国瑞利公司(Reilly Industries Inc.)开发的另一条路线,以环戊二烯和丙醛为起始原料,直接环合生成2-氯-5-氯甲基吡啶,产品纯度高达95%以上,不含异构体2-氯-3-氯甲基吡啶。

2-氯-5-氯甲基吡啶(70258-18-3)谱图信息

GC-MS
GC-MS
1H NMR300 MHzDMSO
1H NMR
13C NMR
13C NMR

2-氯-5-氯甲基吡啶(70258-18-3)参考资料

Reaxys RN:
1635690
Beilstein:
MFCD00125366
PubChem CID:

2-氯-5-氯甲基吡啶(70258-18-3) MSDS

基础信息

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 NamecontentEINECS#
70258-18-32-Chloro-5-chloromethylpyridine90unlisted
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