diisopropyl cyanomethylphosphonate | 58264-04-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机膦酸及其衍生物
• 英文名称: diisopropyl cyanomethylphosphonate
• 英文别名: Isopropyl-1-cyano-1-methylethyl-methylphosphonat；2-Methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropanenitrile
• CAS: 58264-04-3
• 化学式: C₈H₁₆NO₃P
• 分子量: 205.194
• InChiKey: XUOJDUXXUDKAQZ-UHFFFAOYSA-N

物化性质

• 沸点：
  108-110°C 0,08mm
• 密度：
  1,039 g/cm3
• 闪点：
  >110°C
• 稳定性/保质期：
  避免接触水

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  13
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  59.3
• 氢给体数：
  0
• 氢受体数：
  4

安全信息

• 危险等级：
  6.1(a)
• 危险类别码：
  R26/27/28,R34
• 危险品运输编号：
  UN 2927
• 包装等级：
  II
• 危险类别：
  6.1(a)
• 安全说明：
  S26,S36/37/39,S45
• 储存条件：
  在密封的贮藏器中，并存放在阴凉、干燥处避光保存。

SDS

Name:	Diisopropyl Cyanomethylphosphonate 97% Material Safety Data Sheet
Synonym:	None known
CAS:	58264-04-3

Section 1 - Chemical Product MSDS Name:Diisopropyl Cyanomethylphosphonate 97% Material Safety Data Sheet
Synonym:None known

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
58264-04-3	Diisopropyl Cyanomethylphosphonate	97	unlisted

Hazard Symbols: T+ C
Risk Phrases: 26/27/28 34

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Very toxic by inhalation, in contact with skin and if swallowed.
Causes burns.Corrosive.
Potential Health Effects
Eye:
Causes eye burns. May cause chemical conjunctivitis and corneal damage.
Skin:
Causes skin burns. May cause skin rash (in milder cases), and cold and clammy skin with cyanosis or pale color.
Ingestion:
May cause severe and permanent damage to the digestive tract. Causes gastrointestinal tract burns. May cause perforation of the digestive tract. May cause systemic effects.
Inhalation:
Causes chemical burns to the respiratory tract. Aspiration may lead to pulmonary edema. May cause systemic effects.
Chronic:
Effects may be delayed.

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Section 4 - FIRST AID MEASURES
Eyes: Get medical aid. Do NOT allow victim to rub eyes or keep eyes closed. Extensive irrigation with water is required (at least 30 minutes).
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Destroy contaminated shoes.
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.
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. Do NOT use mouth-to-mouth resuscitation. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Use water spray to keep fire-exposed containers cool. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Containers may explode when heated.
Extinguishing Media:
Cool containers with flooding quantities of water until well after fire is out. Use water spray, dry chemical, carbon dioxide, or appropriate foam.

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Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Avoid runoff into storm sewers and ditches which lead to waterways.
Clean up spills immediately, observing precautions in the Protective Equipment section. Remove all sources of ignition. Absorb spill using an absorbent, non-combustible material such as earth, sand, or vermiculite. Do not use combustible materials such as sawdust.
Provide ventilation.

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Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Keep container tightly closed. Do not ingest or inhale.
Discard contaminated shoes.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

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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# 58264-04-3: 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:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

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Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Liquid
Color: clear, colorless
Odor: almond-like
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 108 - 110 deg C @ .08mm Hg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: 110 deg C ( 230.00 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: 1.0390g/cm3
Molecular Formula: C8H16NO3P
Molecular Weight: 205.20

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Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, ignition sources, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, phosphine, carbon monoxide, oxides of phosphorus, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 58264-04-3 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Diisopropyl Cyanomethylphosphonate - 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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

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Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: T+ C
Risk Phrases:
R 26/27/28 Very toxic by inhalation, in contact with
skin and if swallowed.
R 34 Causes burns.
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
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# 58264-04-3: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 58264-04-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 58264-04-3 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：

  diisopropyl cyanomethylphosphonate 、 异丁硫醇 、 盐酸 以95%的产率得到
  参考文献：
  名称：

  YUXNO, YU. M.;UFIMTSEV, S. V.;BARBASHOV, V. V., XIMIYA I TEXNOL. EHLEMENTOORGAN. POLUPRODUKTOV I POLIMEROV, VOLGOGRAD, 19+

  摘要：

  DOI：
• 作为产物：
  描述：

  2-丙基甲基氯膦酸酯 、 丙酮氰醇 在 三乙胺 作用下， 以 乙醚 为溶剂， 生成 diisopropyl cyanomethylphosphonate
  参考文献：
  名称：

  Shishkin,V.E. et al., Journal of general chemistry of the USSR, 1975, vol. 45, p. 2369 - 2371

  摘要：

  DOI：

文献信息

• Shishkin,V.E. et al., Journal of general chemistry of the USSR, 1975, vol. 45, p. 2369 - 2371
  作者：Shishkin,V.E. et al.

  DOI：——

  日期：——
• YUXNO, YU. M.;UFIMTSEV, S. V.;BARBASHOV, V. V., XIMIYA I TEXNOL. EHLEMENTOORGAN. POLUPRODUKTOV I POLIMEROV, VOLGOGRAD, 19+
  作者：YUXNO, YU. M.、UFIMTSEV, S. V.、BARBASHOV, V. V.

  DOI：——

  日期：——