Cas no 23519-26-8 (Phenol,4-[(1E)-1-ethyl-2-[4-(phosphonooxy)phenyl]-1-buten-1-yl]-, 1-(dihydrogenphosphate), sodium salt (1:4))

Phenol,4-[(1E)-1-ethyl-2-[4-(phosphonooxy)phenyl]-1-buten-1-yl]-, 1-(dihydrogenphosphate), sodium salt (1:4) structure
23519-26-8 structure
Product Name:Phenol,4-[(1E)-1-ethyl-2-[4-(phosphonooxy)phenyl]-1-buten-1-yl]-, 1-(dihydrogenphosphate), sodium salt (1:4)
CAS No:23519-26-8
MF:C18H18Na4O8P2
MW:516.237330913544
CID:254370
PubChem ID:3034148
Update Time:2025-04-19

Phenol,4-[(1E)-1-ethyl-2-[4-(phosphonooxy)phenyl]-1-buten-1-yl]-, 1-(dihydrogenphosphate), sodium salt (1:4) Chemical and Physical Properties

Names and Identifiers

    • Phenol,4-[(1E)-1-ethyl-2-[4-(phosphonooxy)phenyl]-1-buten-1-yl]-, 1-(dihydrogenphosphate), sodium salt (1:4)
    • Phenol,4-[(1E)-1-ethyl-2-[4-(phosphonooxy)phenyl]-1-buten-1-yl]-, 1-(dihydrogenphosphate), sod...
    • 23519-26-8
    • Diethylstilbestrol diphosphate tetrasodium salt
    • Fosfestrol Sodium
    • Sodium diethylstilbesterol diphosphate
    • FOSFESTROL TETRASODIUM [WHO-DD]
    • 4,4'-Stilbenediol, alpha,alpha'-diethyl-, bis(dihydrogen phosphate), tetrasodium salt, (E)-
    • Tetrasodium diethylstilbestrol phosphate
    • 4,4'-Stilbenediol, alpha,alpha'-diethyl-, diphosphate tetrasodium salt
    • Fosfestrol sodium salt
    • Stilphostrol (TN)
    • Phenol, 4,4'-[(1E)-1,2-diethyl-1,2-ethenediyl]bis-, bis(dihydrogenphosphate), tetrasodium salt
    • 4,4'-Dihydroxy-alpha,alpha'-diethyl-stilben-diphosphate tetrasodium
    • Stilbestrol diphosphate sodium
    • G9I1882VSD
    • (E)-.ALPHA.,.ALPHA.'-DIETHYLSTILBENE-4,4'-DIOL BIS(DIHYDROGEN PHOSPHATE), TETRASODIUM SALT
    • Sodium (E)-hex-3-ene-3,4-diylbis(4,1-phenylene) bis(phosphate)
    • D07826
    • EINECS 225-209-6
    • 4,4'-Stilbenediol, alpha,alpha'-diethyl-, bis(dihydrogen phosphate), tetrasodium salt (E)-
    • Diethylstilbestrol diphosphate tetrasodium
    • Tetrasodium fosfestrol
    • Honvol
    • Q27278967
    • Fosfestrol tetrasodium salt
    • UNII-G9I1882VSD
    • Phenol, 4,4'-(1,2-diethyl-1,2-ethenediyl)bis-, bis(dihydrogen phosphate), sodium salt, (E)-
    • ANHYDROUS FOSFESTROL TETRASODIUM
    • A914901
    • Fosfestrol tetrasodium
    • tetrasodium;[4-[(E)-4-(4-phosphonatooxyphenyl)hex-3-en-3-yl]phenyl] phosphate
    • Diethylstilbestrol 4,4'-di(disodium phosphate)
    • 4719-75-9
    • FOSFESTROL TETRASODIUM SALT [MI]
    • Honvan tetrasodium
    • FOSFESTROL SODIUM [MART.]
    • Tetrasodium (E)-4,4'-(1,2-diethylethylene)diphenyl bis(phosphate)
    • Inchi: 1S/C18H22O8P2.4Na/c1-3-17(13-5-9-15(10-6-13)25-27(19,20)21)18(4-2)14-7-11-16(12-8-14)26-28(22,23)24;;;;/h5-12H,3-4H2,1-2H3,(H2,19,20,21)(H2,22,23,24);;;;/q;4*+1/p-4/b18-17+;;;;
    • InChI Key: XGZAXRQNRRXUMY-MJCKVQKWSA-J
    • SMILES: P(=O)([O-])([O-])OC1C=CC(=CC=1)/C(/CC)=C(/C1C=CC(=CC=1)OP(=O)([O-])[O-])\CC.[Na+].[Na+].[Na+].[Na+]

Computed Properties

  • Exact Mass: 516.007
  • Monoisotopic Mass: 516.007
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 6
  • Complexity: 545
  • Covalently-Bonded Unit Count: 5
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 145A^2

Experimental Properties

  • Density: 1.433
  • Boiling Point: 648.7°Cat760mmHg
  • Flash Point: 346.1°C
  • PSA: 164.46000
  • LogP: 6.11320
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