Basic information
- CAS
993-43-1- Standard SMILES
CCP(=S)(Cl)Cl- InChIKey
FRNHPBDNOSCJNW-UHFFFAOYSA-N- Molecular formula
- C2H5Cl2PS
- Average molar mass
- 163.01 g/mol
- Monoisotopic mass
- 161.92266315
Overview
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.
Names & identifiers
- Preferred name
- ethyl phosphonothioic dichloride, anhydrous
- IUPAC
- dichloro-ethyl-sulfanylidene-λ5-phosphane
- English name
- Ethylphosphonothioic dichloride
- Molecular formula
- C2H5Cl2PS?
- Molecular weight
- 163.01
Names & synonyms
Show more names
Database identifiers
- CAS
993-43-1- PubChem CID
- 61246
- DTXSID
DTXSID6027347- UNII
- X7NUN2K5DC
- EC Number
- 213-609-3
- Nikkaji
- J298.593D
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 32.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 75.6
Experimental & physicochemical properties
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]
Physicochemical properties
- solubility
- Chloroform (Sparingly)
- form
- Oil
- color
- Colourless to Light Brown
- FDA UNII
- 7 NUN2K5DC · X7NUN2K5DC
- EPA Substance Registry System
- Ethylphosphonothioic dichloride (993-43-1)
- TSCA
- TSCA listed
Safety & regulation
Hazard information
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
Safety & protection
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:
Toxicology
Regulatory information
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.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
Applications
UsesEthylthiophosphonic Dichloride is an intermediate in the sythesis of Fonofos (F684000). It is an organothiophosphate insecticide primarily used on corn.
General DescriptionA 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.
Upstream & downstream products
Upstream raw materials
Suppliers4 total
Related reactions
Compound notes
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