Cas no 62750-94-1 (Phosphoric acid, methyl bis(3-methylphenyl) ester)

Phosphoric acid, methyl bis(3-methylphenyl) ester structure
62750-94-1 structure
Product Name:Phosphoric acid, methyl bis(3-methylphenyl) ester
CAS No:62750-94-1
MF:C15H17O4P
MW:292.266845464706
CID:433148
PubChem ID:71056967
Update Time:2025-04-19

Phosphoric acid, methyl bis(3-methylphenyl) ester Chemical and Physical Properties

Names and Identifiers

    • Phosphoric acid, methyl bis(3-methylphenyl) ester
    • methyl bis(3-methylphenyl) phosphate
    • DTXSID40744133
    • 62750-94-1
    • SCHEMBL14047522
    • Inchi: 1S/C15H17O4P/c1-12-6-4-8-14(10-12)18-20(16,17-3)19-15-9-5-7-13(2)11-15/h4-11H,1-3H3
    • InChI Key: FUXHPPIVOXVGBB-UHFFFAOYSA-N
    • SMILES: P(=O)(OC)(OC1=CC=CC(C)=C1)OC1=CC=CC(C)=C1

Computed Properties

  • Exact Mass: 292.08651
  • Monoisotopic Mass: 292.08644602g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 5
  • Complexity: 319
  • 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
  • XLogP3: 3.9
  • Topological Polar Surface Area: 44.8?2

Experimental Properties

  • PSA: 44.76
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