基本情報
- 標準SMILES
CCP(=S)(Cl)Cl- InChIKey
FRNHPBDNOSCJNW-UHFFFAOYSA-N- 分子式
- C2H5Cl2PS
- 平均分子量
- 163.01 g/mol
- 単同位体質量
- 161.92266315
概要
Ethyl phosphonothioic dichloride, anhydrous appears as a clear colorless liquid with a pungent odor. Burns, but may be difficult to ignite. Denser than water. Very toxic by inhalation. Corrosive to metals and tissue.
名称と識別子
- 優先名称
- ethyl phosphonothioic dichloride, anhydrous
- IUPAC
- dichloro-ethyl-sulfanylidene-λ5-phosphane
- 現地名
- エチルホスフィノチオイリデンジクロリド
- 英語名
- Ethylphosphonothioic dichloride
- 分子式
- C2H5Cl2PS?
- 分子量
- 163.01
名称と別名
名称をさらに表示
データベース識別子
- CAS
993-43-1- PubChem CID
- 61246
- DTXSID
DTXSID6027347- UNII
- X7NUN2K5DC
- EC Number
- 213-609-3
- Nikkaji
- J298.593D
物性
構造計算による物性
- XLogP
- 3
- 極性表面積
- 32.1 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 1
- 回転可能結合数
- 1
- 重原子数
- 6
- 形式電荷
- 0
- 複雑度
- 75.6
実験および物理化学的性質
Vapor Pressure
1.45 mmHg at 70 °F (USCG, 1999)
1.4 [mmHg]
Physical Description
Ethyl phosphonothioic dichloride, anhydrous appears as a clear colorless liquid with a pungent odor. Burns, but may be difficult to ignite. Denser than water. Very toxic by inhalation. Corrosive to metals and tissue.
Clear liquid with a sulfur or phosphorus odor; [CHEMINFO MSDS]
物理化学的性質
- 溶解性
- Chloroform (Sparingly)
- 外見
- Oil
- 色
- Colourless to Light Brown
- EPAの化学物質情報
- Ethylphosphonothioic dichloride (993-43-1)
安全と法規制
危険有害性情報
Fire Hazards
Combustible. POISONOUS GASES ARE PRODUCED IN FIRE. Oxides of sulfur, phosphorus; hydrogen chloride and phosgene. Contact with water applied to adjacent fires will produce irritating fumes of hydrogen chloride. (USCG, 1999)
· Non-combustible, substance itself does not burn but may decompose upon heating to produce corrosive and/or toxic fumes.
Health Hazards
GAS PRODUCED IN REACTION WITH WATER. POISONOUS IF INHALED. Irritating to eyes, nose and throat. LIQUID: Irritating to skin and eyes. Harmful if swallowed. (USCG, 1999)
· TOXIC and/or CORROSIVE; inhalation, ingestion or skin contact with material may cause severe injury or death.
Hazards Summary
In inhalation studies, animals survive 50 mg/m3 (7.5 ppm) for 1 hour or 5 mg/m3 (0.75 ppm) for 4 hours. At 500 mg/m3 (75 ppm) death occurs in less than 1 hour following labored respiration and lung hemorrhage. Corrosive to skin, eyes, and respiratory tract; [CHEMINFO MSDS] Reacts with water to release hydrogen chloride; [CAMEO]
Reactivity Profile
An acid halide and organothiophosphate. Acid halides are water reactive; some are violently reactive. They are incompatible with strong oxidizing agents, alcohols, amines, alkali. May react vigorously or explosively if mixed with diisopropyl ether or other ethers in the presence of trace amounts of metal salts [J. Haz. Mat., 1981, 4, 291]. Organothiophosphates are susceptible to formation of highly toxic and flammable phosphine gas in the presence of strong reducing agents such as hydrides. Partial oxidation by oxidizing agents may result in the release of toxic phosphorus oxides.
DOT Hazard Classification
Ethyl phosphonothioic dichloride, anhydrous
NA2927
Div 6.1 Poisonous materials (49 eCFR § 173.132)
Div 6.1 Poisonous materials (49 eCFR § 173.132)
PG I: the degree of danger presented by the material is great
Symbol D: The proper shipping name which is appropriate for describing material for domestic transportation
安全と保護具
Accidental Release Measures
· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.
· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.
First Aid
INHALATION: remove victim from exposure; oxygen can be used for pulmonary symptoms with decongestants; enforce complete rest, because effects may be delayed 24 hours; similar to phosgene poisoning.
General First Aid:
Exposure Control and Personal Protection
· Wear positive pressure self-contained breathing apparatus (SCBA).
TIH (Toxic Inhalation Hazard) - Term used to describe gases and volatile liquids that are toxic when inhaled. Some are TIH materials themselves, e.g., chlorine, and some release TIH gases when spilled in water, e.g., chlorosilanes. [ERG 2016].
Isolation and Evacuation
Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Immediate precautionary measure
Small spill:
Small spill:
毒性情報
法規制情報
DHS Chemicals of Interest (COI)
Ethylphosphonothioic dichloride
30.00
2.2
Chemical Weapons/Chemical Weapons Precursors chemical material that, if stolen or diverted, can be converted into weapons using simple chemistry, equipment, or techniques.
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
応用分野
一般的な説明A clear colorless liquid with a pungent odor. Burns, but may be difficult to ignite. Denser than water. Very toxic by inhalation. Corrosive to metals and tissue.
調製方法
Ethylthiophosphonic acid dichloride is prepared by the reaction of thiophosphoryl chloride with (C2H5)3Al2Cl3or (C2H5)3Al (Ethyl process).
上流・下流製品情報
上流原料
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