Cas no 16700-95-1 (1-Hexadecanol, hydrogenphosphate, zinc salt (8CI,9CI))

1-Hexadecanol, hydrogenphosphate, zinc salt (8CI,9CI) structure
16700-95-1 structure
Product Name:1-Hexadecanol, hydrogenphosphate, zinc salt (8CI,9CI)
CAS No:16700-95-1
MF:C32H66O4PZn
MW:611.2468085289
CID:172889
PubChem ID:11970390
Update Time:2025-04-19

1-Hexadecanol, hydrogenphosphate, zinc salt (8CI,9CI) Chemical and Physical Properties

Names and Identifiers

    • 1-Hexadecanol, hydrogenphosphate, zinc salt (8CI,9CI)
    • zinc dihexadecyl phosphate
    • phosphoranolate, 1,1-bis(hexadecyloxy)-, oxide, zinc salt (1:1)
    • zinc;dihexadecyl phosphate
    • EINECS 240-751-3
    • 16700-95-1
    • NS00086340
    • Inchi: 1S/C32H67O4P.Zn/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-37(33,34)36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h3-32H2,1-2H3,(H,33,34);/q;+2/p-1
    • InChI Key: QPZXFEBDAHZJST-UHFFFAOYSA-M
    • SMILES: [Zn+2].P(=O)([O-])(OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 609.39928
  • Monoisotopic Mass: 609.399019
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 38
  • Rotatable Bond Count: 32
  • Complexity: 425
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 58.6

Experimental Properties

  • Density: g/cm3
  • Boiling Point: 600.4°Cat760mmHg
  • Flash Point: 316.9°C
  • PSA: 58.59
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