2-Chloroethylphosphoryl Dichloride - ≥97%(GC)(T) , CAS No.1455-05-6

CAS: 1455-05-6 Cat. No.: C154032 Formula: C₂H₄Cl₃O₂P Peso molecolare: 197.38 Numero EC: 679-589-7

GRADE & PURITY ≥97%(GC)(T)

Synonyms

D89210 | SCHEMBL8460588 | BAA45505 | 1-chloro-2-dichlorophosphoryloxyethane | DTXSID80932618 | phosphoryloxyethyl chloride | FT-0633558 | 2-Chloroethyl Dichlorophosphate | 2-Chloroethylphosphoric Acid Dichloride | 2-Chloroethyl dichloridophosphate # | 2-C

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

D89210 | SCHEMBL8460588 | BAA45505 | 1-chloro-2-dichlorophosphoryloxyethane | DTXSID80932618 | phosphoryloxyethyl chloride | FT-0633558 | 2-Chloroethyl Dichlorophosphate | 2-Chloroethylphosphoric Acid Dichloride | 2-Chloroethyl dichloridophosphate # | 2-C

Specifiche e purezza

≥97%(GC)(T)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥97%(GC)(T)

Nomi e identificatori

• Sorrisi canonici: C(CCl)OP(=O)(Cl)Cl
• IUPAC Name: 1-chloro-2-dichlorophosphoryloxyethane
• InChIKey: YRTAUZXAHQPFJV-UHFFFAOYSA-N
• INCHI: 1S/C2H4Cl3O2P/c3-1-2-7-8(4,5)6/h1-2H2
• Isomeri SMILES: C(CCl)OP(=O)(Cl)Cl
• Peso molecolare: 197.38
• Reaxy-Rn: 1704024
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1704024&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Organic phosphoric acids and derivatives
      • Subclass Phosphate esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Organic phosphoric acids and derivatives
• Subclass: Phosphate esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Phosphate esters
• Alternative Parents: Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Phosphoric acid ester - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phosphate esters. These are organic compounds containing phosphoric acid ester functional group, with the general structure R1P(=O)(R2)OR3. R1,R2 = O,N, or halogen atom; R3 = 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

Proprietà chimiche e fisiche

• Sensibilità: Moisture Sensitive
• Indice di rifrazione: 1.47
• Punto di ebollizione (°C): 100°C/20mmHg(lit.)
• Peso molecolare: 197.380 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 195.901 Da
• Monoisotopic Mass: 195.901 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 99.500
• 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

Domande frequenti

What is the purity of this product, and how is it determined?

This product is supplied at ≥97% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1455-05-6, the molecular formula is C2H4Cl3O2P, and the molecular weight is 197.38 g/mol. InChIKey YRTAUZXAHQPFJV-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.