Cas no 159213-45-3 (Benzaldehyde,4,4',4''-[phosphinothioylidynetris(oxy)]tris-)

Benzaldehyde,4,4',4''-[phosphinothioylidynetris(oxy)]tris- structure
159213-45-3 structure
Product Name:Benzaldehyde,4,4',4''-[phosphinothioylidynetris(oxy)]tris-
CAS No:159213-45-3
MF:C21H15O6PS
MW:426.378965616226
CID:231591
PubChem ID:7168226
Update Time:2025-04-19

Benzaldehyde,4,4',4''-[phosphinothioylidynetris(oxy)]tris- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde,4,4',4''-[phosphinothioylidynetris(oxy)]tris-
    • 4-bis(4-formylphenoxy)phosphinothioyloxybenzaldehyde
    • NULL
    • Thiophosphoryl-PMMH-3 Dendrimer
    • Thiophosphoryl-PMMH-3 DendriMer, Generation 0.5
    • THIOPHOSPHORYL-PMMH-3 DENDRIMER,GENERATION
    • Dendrimer
    • Phosphorus dendrimer
    • thiophosphoryl-pmmh-3dendrime
    • Tris(4-formylphenoxy)thiophosphorus
    • THIOPHOSPHORYL-PMMH-3 DENDRIMER GENERA
    • DTXSID90428239
    • O,O,O-TRIS(4-FORMYLPHENYL) PHOSPHOROTHIOATE
    • SCHEMBL21191027
    • 159213-45-3
    • Inchi: 1S/C21H15O6PS/c22-13-16-1-7-19(8-2-16)25-28(29,26-20-9-3-17(14-23)4-10-20)27-21-11-5-18(15-24)6-12-21/h1-15H
    • InChI Key: RBHJCKHGVILXFB-UHFFFAOYSA-N
    • SMILES: S=P(OC1C=CC(C=O)=CC=1)(OC1C=CC(C=O)=CC=1)OC1C=CC(C=O)=CC=1

Computed Properties

  • Exact Mass: 426.03300
  • Monoisotopic Mass: 426.03269637g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 9
  • Complexity: 509
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 5.1
  • Topological Polar Surface Area: 111?2

Experimental Properties

  • Color/Form: White or beige powder
  • Melting Point: 115-119 °C
  • PSA: 120.80000
  • LogP: 5.53600
  • Solubility: Not determined

Benzaldehyde,4,4',4''-[phosphinothioylidynetris(oxy)]tris- Security Information

  • Safety Instruction: S24/25
  • Safety Term:S24/25

Benzaldehyde,4,4',4''-[phosphinothioylidynetris(oxy)]tris- Customs Data

  • HS CODE:29310099

Benzaldehyde,4,4',4''-[phosphinothioylidynetris(oxy)]tris- Production Method

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