Diethyl Chlorothiophosphate - ≥97%(GC) , CAS No.2524-04-1

CAS: 2524-04-1 Cat. No.: D156020 Fórmula: C₄H₁₀ClO₂PS Peso molecular: 188.61 Número EC: 219-755-4

GRADE & PURITY ≥97%(GC)

Synonyms

CAS-2524-04-1 | Diethyl phosphorochloridothionate 100 microg/mL in Acetonitrile | Diethyl chlorothiophosphate | EN300-247255 | NCGC00248890-01 | NSC43776 | NSC-43776 | Diethoxythiophosphoryl chloride | Ethyl PCT | O,O-Diethyl thionophosphoric chloride | 4

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Sinónimos

CAS-2524-04-1 | Diethyl phosphorochloridothionate 100 microg/mL in Acetonitrile | Diethyl chlorothiophosphate | EN300-247255 | NCGC00248890-01 | NSC43776 | NSC-43776 | Diethoxythiophosphoryl chloride | Ethyl PCT | O,O-Diethyl thionophosphoric chloride | 4

Especificaciones y pureza

≥97%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

FedEx DG Service

Pureza

≥97%(GC)

Nombres e identificadores

Pubchem Sid

508814423

Sonrisas canónicas

CCOP(=S)(OCC)Cl

IUPAC Name

chloro-diethoxy-sulfanylidene-λ5-phosphane

InChIKey

KMJJJTCKNZYTEY-UHFFFAOYSA-N

INCHI

1S/C4H10ClO2PS/c1-3-6-8(5,9)7-4-2/h3-4H2,1-2H3

Isómeros SMILES

CCOP(=S)(OCC)Cl

RTECS

TD1780000

Número ONU

2751

Grupo de embalaje

II

Peso molecular

188.61

Reaxy-Rn

471434

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=471434&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Organic thiophosphoric acids and derivatives
      • Subclass Thiophosphoric acid esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Organic thiophosphoric acids and derivatives
• Subclass: Thiophosphoric acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Thiophosphoric acid esters
• Alternative Parents: Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Thiophosphoric acid ester - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as thiophosphoric acid esters. These are organic compounds containing the thiophosphoric acid functional group or a derivative thereof, with the general structure ROP(OR')(OR'')=S, where at least one R-group is an organyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Insoluble in water
• Índice de refracción: 1.4700 to 1.4740
• Punto de inflamación (°F): 197.6 °F
• Punto de inflamación (°C): 92°C
• Punto de ebullición (°C): 45 °C/3 mmHg (lit.)
• Peso molecular: 188.610 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 187.983 Da
• Monoisotopic Mass: 187.983 Da
• Topological Polar Surface Area: 50.600 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 109.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1