21959-01-3 (四氯双(四氢呋喃)合锆(IV),Tetrachlorobis(tetrahydrofuran)zirconium)

CAS号:
21959-01-3
中文名称:
四氯双(四氢呋喃)合锆(IV)
英文名称:
Tetrachlorobis(tetrahydrofuran)zirconium
安全信息:
分子式:
C8H16Cl4O2Zr
分子量:
377.247438430786

四氯双(四氢呋喃)合锆(IV)(21959-01-3)名称与标识符

名称

中文别名:
四氯双(四氢呋喃)合锆(IV);四氯双(四氢呋喃)合锆;Zirconium(IV) chloride鮐etrahydrofuran complex;双(四氢呋喃)四氯化锆(IV);四氯化锆四氢呋喃络合物;四氯化锆四氢呋喃络合物 (1:2);四氯化锆四氢呋喃络合物 (1:2) 98%;四氯双(四氢呋喃)锆;
英文别名:
Tetrachlorobis(tetrahydrofuran)zirconium;Zirconium(IV)chloride tetrahydrofuran;oxolane,tetrachlorozirconium;Tetrachlorobis(tetrahydrofuran)zirconium(IV);[ZrCl4(thf)2];tetrachlorobis(tetrahydrofuran-O)zirconium(IV);Zirconium tetrachloride tetrahydrofuran complex;Zirconium(IV) chloride tetrahydrofuran complex (1:2);ZrCl4(tetrahydrofuran)2;oxolane;tetrachlorozirconium;WAA95901;zrcl4(thf)2;SCHEMBL148678;DTXSID4049820;21959-01-3;F87498;MFCD00145367;

标识符

MDL:
MFCD00145367
InChIKey:
VDJJKYYENYIHFF-UHFFFAOYSA-J
Inchi:
1S/2C4H8O.4ClH.Zr/c2*1-2-4-5-3-1;;;;;/h2*1-4H2;4*1H;/q;;;;;;+4/p-4
SMILES:
[Zr](Cl)(Cl)(Cl)Cl.O1CCCC1.O1CCCC1

四氯双(四氢呋喃)合锆(IV)(21959-01-3)物化性质

实验特性

  • LogP : 4.35160
  • PSA : 18.46000
  • 水溶性 : Reacts with water.
  • 沸点 : °Cat760mmHg
  • 熔点 : 175-177 °C (lit.)
  • 蒸气压 : 152 mmHg ( 25 °C)(lit.)
  • 闪点 : °C
  • 颜色与性状 : 未确定2. 密度(g/mL,25/4℃)
  • 敏感性 : Moisture Sensitive

计算特性

  • 精确分子量 : 373.89500
  • 氢键供体数量 : 0
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 0
  • 同位素质量 : 373.895139g/mol
  • 重原子数量 : 15
  • 复杂度 : 41.9
  • 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 : 3
  • 疏水参数计算参考值(XlogP) : 无
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 18.5Ų

四氯双(四氢呋喃)合锆(IV)(21959-01-3)安全信息

四氯双(四氢呋喃)合锆(IV)(21959-01-3)国际标准相关数据

EINECS:

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四氯双(四氢呋喃)合锆(IV)(21959-01-3)上下游

四氯双(四氢呋喃)合锆(IV)(21959-01-3)参考资料

Reaxys RN:
PubChem CID:

四氯双(四氢呋喃)合锆(IV)(21959-01-3) MSDS

基础信息

Name:Tetrachlorobis(tetrahydrofuran)zirconium Material Safety Data Sheet
Synonym:Zirconium(IV) chloride tetrahydrofura
CAS:21959-01-3
Section 1 - Chemical Product ? MSDS Name:Tetrachlorobis(tetrahydrofuran)zirconium Material Safety Data Sheet
Synonym:Zirconium(IV) chloride tetrahydrofura

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
21959-01-3Tetrachlorobis(tetrahydrofuran)zirconiunlisted
Hazard Symbols: C
Risk Phrases: 20/21/22 34

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed. Causes burns.Air sensitive.Moisture sensitive.
Potential Health Effects
Eye:
Causes eye burns.
Skin:
Harmful if absorbed through the skin. Causes skin burns.
Ingestion:
Harmful if swallowed. Causes gastrointestinal tract burns.
Inhalation:
Harmful if inhaled. Causes chemical burns to the respiratory tract.
Chronic:
Not available.

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 immediately.
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid immediately. Wash mouth out with water.
Inhalation:
Get medical aid immediately. 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:
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.

Section 7 - HANDLING and STORAGE
? Handling:
Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Use only in a chemical fume hood.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Corrosives area. Store under nitrogen.

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# 21959-01-3: Personal Protective Equipment Eyes: Not available.
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: Powder
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 175 - 177 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C8H16Cl4O2Zr
Molecular Weight: 377.1428

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials, exposure to air, exposure to moist air or water.
Incompatibilities with Other Materials:
Strong oxidizing agents, alcohols, amines, acids.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 21959-01-3 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Tetrachlorobis(tetrahydrofuran)zirconium - 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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with
skin and if swallowed.
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# 21959-01-3: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 21959-01-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 21959-01-3 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A