Eaton′s Reagent - P2O5 ca 7.5% w/w , CAS No.39394-84-8

CAS: 39394-84-8 Cat. No.: E140657 Número EC: 679-375-3

GRADE & PURITY P2O5 ca 7.5% w/w

Synonyms

Methanesulfonic acid--3-oxo-1lambda~5~,3lambda~5~-diphosphoxane-1,1,3-trione (1/1) | D78003 | methanesulfonic acid compound with phosphenic anhydride (1:1) | AKOS027469870 | Eaton's Reagent | Phosphorus pentoxide methanesulfonic acid | eaton'S | MFCD00070

Storage

Room temperature,Argon charged,Desiccated,Cool

Shipped In

Normal

Specifications

Sinónimos

Methanesulfonic acid--3-oxo-1lambda~5~, 3lambda~5~-diphosphoxane-1, 1, 3-trione (1/1) | D78003 | methanesulfonic acid compound with phosphenic anhydride (1:1) | AKOS027469870 | Eaton's Reagent | Phosphorus pentoxide methanesulfonic acid | eaton'S | MFCD00070

Especificaciones y pureza

P2O5 ca 7.5% w/w

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged, Desiccated, Cool

Enviado en

Normal

Nombres e identificadores

• Sonrisas canónicas: CS(=O)(=O)O.O=P(=O)OP(=O)=O
• InChIKey: JHNLZOVBAQWGQU-UHFFFAOYSA-N
• INCHI: 1S/CH4O3S.O5P2/c1-5(2,3)4;1-6(2)5-7(3)4/h1H3,(H,2,3,4)
• Isómeros SMILES: CS(=O)(=O)O.O=P(=O)OP(=O)=O
• WGK Alemania: 1
• Número ONU: 1760
• Grupo de embalaje: II
• Reaxy-Rn: 20559020
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=20559020&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Organic sulfonic acids and derivatives
      • Subclass Organosulfonic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Organic sulfonic acids and derivatives
• Subclass: Organosulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Organosulfonic acids
• Alternative Parents: Sulfonyls Methanesulfonates Alkanesulfonic acids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Methanesulfonate - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organosulfonic acids. These are compounds containing the sulfonic acid group, which has the general structure RS(=O)2OH (R is not a hydrogen atom).
• 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: Decomposes in water.
• Sensibilidad: Moisture Sensitive.
• Índice de refracción: 1.435
• Punto de inflamación (°F): 230°F
• Punto de inflamación (°C): >110°C
• Punto de ebullición (°C): 122 °C/1 mmHg
• Peso molecular: 238.050 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 0
• Exact Mass: 237.91 Da
• Monoisotopic Mass: 237.91 Da
• Topological Polar Surface Area: 140.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 216.000
• 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: 2

XLogP3

Referencias

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