1,12-二氯十二烷 | 3922-28-9

• 分子结构分类: 有机化合物 - 有机卤素化合物 - 有机氯化物
• 中文名称: 1,12-二氯十二烷
• 英文名称: 1,12-dichlorododecane
• CAS: 3922-28-9
• 化学式: C₁₂H₂₄Cl₂
• mdl: MFCD00039368
• 分子量: 239.229
• InChiKey: RNXPZVYZVHJVHM-UHFFFAOYSA-N

物化性质

• 熔点：
  28-30 °C(lit.)
• 沸点：
  170-172 °C10 mm Hg(lit.)
• 密度：
  0.95
• 闪点：
  >230 °F
• 稳定性/保质期：

  在常温常压下保持稳定，应避免与不相容的材料接触。

计算性质

• 辛醇/水分配系数(LogP)：
  6.1
• 重原子数：
  14
• 可旋转键数：
  11
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

安全信息

• 危险品标志：
  Xi
• 海关编码：
  2903199000
• 储存条件：
  密封储存，应存放于阴凉干燥的库房中，严禁使用金属容器盛放。

SDS

Name:	1 12-Dichlorododecane 98+% Material Safety Data Sheet
Synonym:	None Known
CAS:	3922-28-9

Section 1 - Chemical Product MSDS Name:1 12-Dichlorododecane 98+% Material Safety Data Sheet
Synonym:None Known

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
3922-28-9	1,12-Dichlorododecane	98+%	223-492-0

Hazard Symbols: XI
Risk Phrases: 38

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to skin.The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
Causes skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
Chronic:
No information found.

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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. 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.
Notes to Physician:

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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. Dusts at sufficient concentrations can form explosive mixtures with air. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Will burn if involved in a fire.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam. Use agent most appropriate to extinguish fire.

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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.

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Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Use with adequate ventilation.
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.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Do not store in metal containers.

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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# 3922-28-9: Personal Protective Equipment Eyes: Wear chemical splash goggles.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to minimize contact with skin.
Respirators:
A NIOSH/MSHA approved air purifying dust or mist respirator or European Standard EN 149.

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Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Solid
Color: after melting, clear colorless
Odor: Characteristic.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: mPas 40 deg C
Boiling Point: 299 deg C @ 760.00mm Hg
Freezing/Melting Point: 29 deg C
Autoignition Temperature: 210 deg C ( 410.00 deg F)
Flash Point: 168 deg C ( 334.40 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water: 0.03 G/L (20C)
Specific Gravity/Density: .9530g/cm3
Molecular Formula: C12H24Cl2
Molecular Weight: 239.23

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Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, dust generation, excess heat.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported.

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 3922-28-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1,12-Dichlorododecane - Not listed by ACGIH, IARC, or NTP.

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Section 12 - ECOLOGICAL INFORMATION

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Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

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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:

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Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 38 Irritating to skin.
Safety Phrases:
S 37 Wear suitable gloves.
WGK (Water Danger/Protection)
CAS# 3922-28-9: 2
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 3922-28-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 3922-28-9 is not listed on the TSCA inventory.
It is for research and development use only.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  1,12-二氯十二烷 在 镍 氨 、 氢气 作用下， 以 甲醇 、 N,N-二甲基甲酰胺 为溶剂， 生成 1,14-十四烷二胺
  参考文献：
  名称：

  α, α, α, ω-四氯烷烃合成α, ω-二取代高级烷烃

  摘要：

  通过改进的 α, α, α, ω-四氯烷烃的水解方法，以良好的产率（超过 90%）制备了比 ω-氯辛酸更高的 ω-氯烷酸。反应在发烟硝酸中进行，在反应过程中加入二氧化氮或在少量磷酸酐的存在下进行。α, ω-二氯烷烃通过 Kolbe 电解合成衍生自 ω-氯代链烷酸。还从四氯烷烃开始制备了各种其他具有很长亚甲基链的新型 α, ω-二取代烷烃，例如二醇、二腈、二羧酸和二胺。

  DOI：

  10.1246/bcsj.39.480
• 作为产物：
  描述：

  12-Carbonochloridoyloxydodecyl carbonochloridate 在 hexabutylguanidinium chloride 作用下， 反应 4.0h， 以88%的产率得到1,12-二氯十二烷
  参考文献：
  名称：

  通过催化分解相应的烷基和烷氧基烷基氯甲酸酯和双氯甲酸酯与六丁基亚砜来制备烷基和烷氧基烷基氯化物和二氯化物的安全有效方法

  摘要：

  少量六丁基氯化胍 (0.01 mol%) 通过半连续过程分解具有不同长度碳链的纯氯甲酸酯或双氯甲酸酯，以降低失控风险，从而产生高产率和纯度的氯化物化合物。

  DOI：

  10.1081/scc-100000525

文献信息

• Novel epoxide derivatives of allylarylphenols
  申请人：——

  公开号：US20020151731A1

  公开（公告）日：2002-10-17

  The present invention relates to novel epoxides having the formulas 1 where Y is a CO, CO 2 or SO 2 , AR is the same or different divalent unsubstituted or substituted aromatic, halogen-substituted aromatic or cyano-substituted aromatic hydrocarbon radical having from 6 to 20 carbon atoms, Z is a divalent hydrocarbon or ether radical having from 1 to 20 carbon atoms, including Y—Z—Y being CO, and R* is an alkyl, aryl, arylalkyl, alkoxy, aryloxy or arylalkoxy radical having from 0-20 carbon atoms. The epoxides of the present invention are useful in the formation of epoxy resins.

  本发明涉及具有以下公式的新环氧化合物：1其中Y是CO、CO2或SO2，AR是相同或不同的二价未取代或取代的芳香族、卤素取代的芳香族或氰基取代的芳香族碳氢化合物基团，其含有6至20个碳原子，Z是具有1至20个碳原子的二价碳氢化合物或醚基团，包括Y—Z—Y为CO，R*是具有0-20个碳原子的烷基、芳基、芳烷基、烷氧基、芳氧基或芳烷氧基。本发明的环氧化合物在形成环氧树脂时很有用。
• One-step synthesis of 1,n-dicarbonyl compounds from carboxylic acid derivatives and di-Grignard reagents in the presence of transition metal catalysts
  作者：F. Babudri、A. D'Ettole、V. Fiandanese、G. Marchese、F. Naso

  DOI：10.1016/0022-328x(91)83155-w

  日期：1991.3

  The transition metal catalyzed cross-coupling reaction of alkane di-Grignard reagents with carboxylic acid derivatives provides a convenient one-step synthesis of symmetrical 1,n-diketones (n ⩾ 8) and long-chain dicarboxylic thiol esters.

  烷烃二格利雅试剂与羧酸衍生物的过渡金属催化交叉偶联反应提供了一种简便的一步合成方法，用于合成对称的1，n-二酮（n = 8）和长链二羧酸硫醇酯。
• AMINE POLYMERS FOR USE AS BILE ACID SEQUESTRANTS
  申请人：Connor Eric

  公开号：US20140356316A1

  公开（公告）日：2014-12-04

  The present invention provides crosslinked amine polymers effective for binding and removing bile salts from the gastrointestinal tract. These bile acid binding polymers or pharmaceutical compositions thereof can be administered to subjects to treat various conditions, including hypercholesteremia, diabetes, pruritus, irritable bowel syndrome-diarrhea (IBS-D), bile acid malabsorption, and the like.

  本发明提供了交联胺聚合物，用于有效地结合和清除胆盐从胃肠道。这些胆酸结合聚合物或其药物组合物可以被用于治疗各种疾病，包括高胆固醇血症、糖尿病、瘙痒、肠易激综合征-腹泻（IBS-D）、胆酸吸收不良等。
• Transition metal compound, polymerization-initiator system comprising the same, and process for producing polymer
  申请人：Uemura Makoto

  公开号：US20070270521A1

  公开（公告）日：2007-11-22

  A transition metal compound represented by the formula, [(CpR 1 m )(CO) 2 M 1 ][M 2 (CO) 2 (CpR 2 n )], wherein Cp is a cyclopentadienyl ring, R 1 and R 2 are independently of each other a hydrocarbyl group having 1 to 20 carbon atoms, and each of at least one R 1 and at least one R 2 is a hydrocarbyl group having 5 to 20 carbon atoms, m and n are independently of each other an integer of 1 to 5, and M 1 and M 2 are independently of each other a transition metal atom of the group 8 in the periodic table of elements; a polymerization-initiator system comprising said transition metal compound; and a process for producing a polymer in the presence of the polymerization-initiator system.

  一个由该公式表示的过渡金属化合物，[(CpR1m)(CO)2M1][M2(CO)2(CpR2n)]，其中Cp是一个环戊二烯环，R1和R2是独立的烃基团，含有1至20个碳原子，至少一个R1和至少一个R2是含有5至20个碳原子的烃基团，m和n是独立的1至5的整数，M1和M2是元素周期表中8族的过渡金属原子；包括所述过渡金属化合物的聚合物化引发剂系统；以及在聚合物化引发剂系统存在的情况下生产聚合物的过程。
• Direct Reduction of 1-Bromo-6-chlorohexane and 1-Chloro-6-iodohexane at Silver Cathodes in Dimethylformamide
  作者：John A. Rose、Caitlyn M. McGuire、Angela M. Hansen、Jonathan A. Karty、Mohammad S. Mubarak、Dennis G. Peters

  DOI：10.1016/j.electacta.2016.09.066

  日期：2016.11

  electrochemical reductions of 1-bromo-6-chlorohexane and 1‐chloro-6-iodohexane at silver cathodes in dimethylformamide (DMF) containing 0.050 M tetra-n-butylammonium tetrafluoroborate (TBABF4). A cyclic voltammogram for reduction of 1-bromo-6-chlorohexane shows a single major irreversible cathodic peak, whereas reduction of 1-chloro-6-iodohexane gives rise to a pair of irreversible cathodic peaks. Controlled-potential

  循环伏安法和控制的电势（本体）电解已经被用来探测电化学1-溴-6-氯己烷和1-氯-6-碘己烷的在银阴极在二甲基甲酰胺含有0.050中号四减量（DMF）ñ -butylammonium四氟硼酸盐（TBABF 4）。还原1-溴-6-氯己烷的循环伏安图显示了一个主要的不可逆阴极峰，而还原1-氯-6-碘己烷则产生了一对不可逆的阴极峰。在银丝网阴极上对1-溴-6-氯己烷进行的控制电位（本体）电解表明，该过程涉及碳-溴键的两电子裂解，以产生1-氯己烷作为主要产物，以及6-氯-1-己烯，n-己烷，1-己烯和1,5-己二烯为次要物种。相比之下，1-氯-6-碘己烷的大量电解表明，第一个伏安峰对应于一个电子过程，从而导致与1-氯己烷和6-氯-碘一起生成二聚体（1,12-二氯十二烷）。痕量的1-己烯，1-己烯和1,5-己二烯。在对应于第二个阴极峰的电势下，1-氯-6-碘己烷的还原是一步和两步电子的混合物，可产生

表征谱图