Phosphoric Acid Trisdecyl Ester - ≥95% , CAS No.4200-55-9

CAS: 4200-55-9 Cat. No.: P342333 Summenformel: C₃₀H₆₃O₄P Molekulargewicht: 518.79 EG-Nummer: 224-099-7 PubChem CID: 77866

QUALITÄT & REINHEIT ≥95%

Synonyms

DTXSID7063348 | Tridecyl phosphate | SCHEMBL258318 | tris-decyl phosphate | EINECS 224-099-7 | Phosphoric acid, tris(decyl) ester

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Spezifikationen

Synonyme

DTXSID7063348 | Tridecyl phosphate | SCHEMBL258318 | tris-decyl phosphate | EINECS 224-099-7 | Phosphoric acid, tris(decyl) ester

Spezifikationen & Reinheit

≥95%

Storage

Store at -20°C,Argon charged

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

528774309

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528774309

Kanonisches Lächeln

CCCCCCCCCCOP(=O)(OCCCCCCCCCC)OCCCCCCCCCC

IUPAC Name

tris-decyl phosphate

InChIKey

KUHPLTBUBAGTDV-UHFFFAOYSA-N

INCHI

1S/C30H63O4P/c1-4-7-10-13-16-19-22-25-28-32-35(31,33-29-26-23-20-17-14-11-8-5-2)34-30-27-24-21-18-15-12-9-6-3/h4-30H2,1-3H3

Isomere SMILES

CCCCCCCCCCOP(=O)(OCCCCCCCCCC)OCCCCCCCCCC

PubChem CID

77866

UN-Nummer

3265

Verpackungsgruppe

I

Molekulargewicht

518.79

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Organic phosphoric acids and derivatives
      • Subclass Phosphate esters
        • Ebene5 Alkyl phosphates
          • Ebene6 Trialkyl phosphates

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Organic phosphoric acids and derivatives
• Subclass: Phosphate esters
• Intermediate Tree Nodes: Alkyl phosphates
• Direct Parent: Trialkyl phosphates
• Alternative Parents: Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkyl phosphate - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as trialkyl phosphates. These are organic compounds containing a phosphate group that is linked to exactly three alkyl chains.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 518.799 g/mol
• XLogP3: 13.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 30
• Exact Mass: 518.446 Da
• Monoisotopic Mass: 518.446 Da
• Topological Polar Surface Area: 44.800 Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 382.000
• 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