乙醇铪 | 13428-80-3

• 物质功能分类: 有机原料 - 有机金属类化合物 - 有机铪、汞、银、铂等
• 分子结构分类: 有机化合物 - 有机盐 - 有机金属盐
• 中文名称: 乙醇铪
• 中文别名: 乙氧化铪
• 英文名称: hafnium ethoxide
• 英文别名: Hf(OEt)4；hafnium(IV) ethoxide；tetraethoxy hafnium；ethanolate;hafnium(4+)
• CAS: 13428-80-3
• 化学式: C₈H₂₀HfO₄
• 分子量: 358.734
• InChiKey: BFIMXCBKRLYJQO-UHFFFAOYSA-N

物化性质

• 熔点：
  178-180°C
• 沸点：
  180-200°C 13mm
• 闪点：
  180°C-200°C/13mm
• 暴露限值：
  ACGIH: TWA 0.5 mg/m3NIOSH: IDLH 50 mg/m3; TWA 0.5 mg/m3
• 稳定性/保质期：

  在常温常压下保持稳定，应避免接触水分、潮湿和氧化物。

计算性质

• 辛醇/水分配系数(LogP)：
  2.14
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  92.2
• 氢给体数：
  0
• 氢受体数：
  4

安全信息

• TSCA：
  No
• 危险等级：
  4.1
• 安全说明：
  S26,S36/37/39
• 危险类别码：
  R36/37/38
• 包装等级：
  II
• 危险类别：
  4.1
• 危险品运输编号：
  UN3180
• 储存条件：
  常温下应存于密闭容器中，并放置在阴凉、通风、干燥处。

SDS

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Section 1: Product Identification
Chemical Name: Hafnium (IV) ethoxide, 99%
CAS Registry Number: 13428-80-3
Formula: Hf4O(OC2H5)14.2C2H5OH
EINECS Number:
Chemical Family: metal alkoxide
Synonym: hafnium ethanolate. ethanol, hafnium salt.

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Section 2: Composition and Information on Ingredients
Ingredient CAS Number Percent ACGIH (TWA) OSHA (PEL)
Title Compound 13428-80-3 100% 0.5mg/m3 (as Hf) 0.5mg/m3 (as Hf)

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Section 3: Hazards Identification
Emergency Overview: Irritating to the respiratory tract, skin and eyes. May be harmful if swallowed.
Primary Routes of Exposure: Inhalation, ingestion, contact with skin and eyes.
Eye Contact: Causes slight to mild irritation of the eyes.
Skin Contact: Causes slight to mild irritation of the skin.
Inhalation: Irritating to skin, eyes and respiratory tract.
Ingestion: Ingestion may cause gastrointestinal distress, nausea, vomiting and headache.
Acute Health Affects: Irritating to skin, eyes and respiratory tract.
No data is available for this product. Prolonged exposure to ethanol vapors may be harmful to nerves and
Chronic Health Affects:
liver.
NTP: No
IARC: No
OSHA: No

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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 soap and water. Remove contaminated clothes if necessary. Seek medical
Skin Exposure:
assistance if 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.
Ingestion: Seek medical attention immediately. Keep the victim calm. Give the victim water (only if conscious).

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SECTION 5: Fire Fighting Measures
Flash Point: not applicable
Autoignition Temperature: no data
Explosion Limits: no data
Extinguishing Medium: carbon dioxide, dry powder or foam
If involved in a fire, fire fighters should be equipped with a NIOSH approved positive pressure self-contained
Special Fire Fighting Procedures:
breathing apparatus and full protective clothing.
Hazardous Combustion and If involved in a fire this material may emit toxic organic fumes.
Decomposion Products:
Unusual Fire or Explosion Hazards: No unusual fire or explosion hazards.

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SECTION 6: Accidental Release Measures
Avoid contact with water. Small spills may be adsorbed into diatomaceous earth, sand, or other suitable
Spill and Leak Procedures:
adsorbent, and swept up.

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SECTION 7: Handling and Storage
Store in a tightly sealed container in a dry place. If container is left open, product may adsorb moisture and
Handling and Storage:
carbon dioxide from the atmosphere and release ethanol vapor.

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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 vapor upon exposure to air. 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 vapor upon exposure to air. if possible, handle the material in an efficient fume hood.
Additional Protection: No additional protection required.

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SECTION 9: Physical and Chemical Properties
Color and Form: white to off-white xtl.
Molecular Weight: 358.73
Melting Point: no data
Boiling Point: no data
Vapor Pressure: no data
Specific Gravity: no data
Odor: alcohol-like odor
Solubility in Water: Reacts with water

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SECTION 10: Stability and Reactivity
Stability: air and moisture sensitive solid
Hazardous Polymerization: no hazardous polymerization
Conditions to Avoid: contact with moisture
Incompatibility: Oxidizing agents and halogens
Decomposition Products: Carbon dioxide, carbon monoxide, organic vapors, and metal oxides and carbonates.

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SECTION 11: Toxicological Information
RTECS Data: No information available in the RTECS files.
Carcinogenic Effects: No data available
Mutagenic Effects: No data available
Tetratogenic Effects: No data available

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SECTION 12: Ecological Information
Ecological Information: No information available

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SECTION 13: Disposal Considerations
Disposal: Dispose of according to local, state and federal regulations.

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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

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SECTION 15: Regulatory Information
TSCA: Not listed in the TSCA inventory.
SARA (Title 313): Title compound not listed.
Second Ingredient: none

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SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  乙醇铪 以 异丙醇 、 乙酰丙酮 为溶剂， 生成 hafnium(IV) oxide
  参考文献：
  名称：

  Oxygen vacancy relationship to photoluminescence and heat treatment methods in hafnium oxide powders

  摘要：

  Hafnium oxide powders were synthesized using the sol-gel method and further subjected to microwave treatment (MT) or conventional heat treatment (CT). The HfO2 powders were transformed into a monoclinic phase with a small crystallite size when using MT at 350 degrees C and CT at 450 degrees C. Both methods gave products possessing photoluminescence (PL) emission bands at approximately 415 and 523 nm. Furthermore, the intensity of the PL was found correlate to the treatment temperature and to the concentration of oxygen vacancies in the powders. (C) 2012 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.jallcom.2012.04.046
• 作为产物：
  描述：

  hafnium borohydride 在 C₂H₅OH 作用下， 以 正戊烷 为溶剂， 生成 乙醇铪 、 硼酸三乙酯
  参考文献：
  名称：

  Petrova, L. A.; Borisov, A. P.; Makhaev, V. D., Koordinatsionnaya Khimiya, 1992, vol. 18, p. 425 - 428

  摘要：

  DOI：

文献信息

• Raman Spectroscopy of Na₂Nb₂O₆•H₂O and Na₂Nb₂_-<i>_x</i>M<i>_x</i>O₆_-<i>_x</i>(OH)<i>_x</i>•H₂O (M = Ti, Hf) Ion Exchangers
  作者：Milko N. Iliev、Mark L. F. Phillips、James K. Meen、Tina M. Nenoff

  DOI：10.1021/jp035840p

  日期：2003.12.1

  The Raman spectra of Sandia Octahedral Molecular Sieves Na 2 Nb 2 - x M x O 6 - x (OH) x .H 2 O (M = Ti, Hf; x ≤ 0.2) (SOMS-Ti and SOMS-Hf) and their parent compound Na 2 Nb 2 O 6 .H 2 O (SOMS) were measured between 24 °C and 600 °C. The spectra of all three materials as well their variations with temperature are almost identical, which indicates that the M 4 + for Nb 5 + disordered substitution has

  Sandia 八面体分子筛 Na 2 Nb 2 - x M x O 6 - x (OH) x .H 2 O (M = Ti, Hf; x ≤ 0.2) (SOMS-Ti 和 SOMS-Hf) 及其拉曼光谱在 24 °C 和 600 °C 之间测量母体化合物 Na 2 Nb 2 O 6 .H 2 O (SOMS)。三种材料的光谱及其随温度的变化几乎相同，这表明Nb 5 + 无序取代的M 4 + 对铌酸盐骨架的结构影响不大。高于 250 °C 的退火导致脱水，反映在拉曼光谱中，在 ∼1700 cm - 1 和 3100-3400 cm - 1 处与水相关的谱带消失，以及一些拉曼线参数的不可逆变化。然而，作为一个整体，频谱在频率范围内发生变化，对应于内部氧振动，与 X 射线衍射图案的剧烈变化相比，它们是相当温和的。这表明尽管SOMS结构在脱水相中重新排列，但基本构成元素NbO 6 八面体和以Na为中心的多面体实际上保持不变。在
• Catechol derivatives of Group 4 and 5 compounds
  作者：Timothy J. Boyle、Louis J. Tribby、Todd M. Alam、Scott D. Bunge、Gregory P. Holland

  DOI：10.1016/j.poly.2005.03.055

  日期：2005.7

  The structural modifications of Group 4 and 5 metal alkoxides using the bidentate catechol (C6H3(OH)2-1,3 = cat-H2) have been investigated. From the reaction of [Ti(μ-ONep)(ONep)3]2 (ONep = OCH2CMe3), [Zr(μ-OPri)(ONep)3 · HONep]2(OPri = OCHMe2), Hf(OEt)4 (OEt = OCH2Me) with 2 equivalents, and M(OEt)5 (M = Nb or Ta) with 3 equiv. of cat-H2 in pyridine (py), the complete removal of alkoxide ligands and

  研究了使用二齿邻苯二酚（C 6 H 3（OH）2 -1,3 = cat-H 2）对第4和5族金属醇盐的结构改性。从反应钛[Ti（μ-ONEP）（ONEP）3 ] 2（ONEP = OCH 2 CME 3），[Zr的（μ-OPR我）（ONEP）3  ·HONEP] 2（OPR我 = OCHMe 2），具有2个当量的Hf（OEt）4（OEt = OCH 2 Me）和具有3个当量的M（OEt）5（M = Nb或Ta）。H 2的在吡啶（py）中，观察到醇盐配体的完全去除和第4组和第5组物种的第一个中性邻苯二酚衍生物的分离。相应的儿茶酚衍生物在结构上表征为：钛3（μ 3 -O）（μ-CAT）3（猫）（猫-H）2（1），锆4（μ 4 -O）（μ-CAT）6（μ-猫-H）2（PY）4（2），HF 4（μ 4 -O）（μ-CAT）6（μ-猫-H）2（PY）4（3），M（猫）2（cat-H）（py）（M =
• Kauffmann, Thomas; Fobker, Rolf; Wensing, Michael, Angewandte Chemie, 1988, vol. 100, # 7, p. 1005 - 1006
  作者：Kauffmann, Thomas、Fobker, Rolf、Wensing, Michael

  DOI：——

  日期：——
• Dicyclooctatetraen-hafnium und derivate
  作者：H.-J. Kablitz、R. Kallweit、G. Wilke

  DOI：10.1016/s0022-328x(00)82900-9

  日期：1972.11
• Gmelin Handbuch der Anorganischen Chemie, Gmelin Handbook: Hf: Org.Verb., 1.4, page 14 - 14
  作者：

  DOI：——

  日期：——