Phenol, 4,4′-(1,2-diethyl-1,2-ethenediyl)bis-, bis(dihydrogen phosphate), disodium salt, (E)-

CAS Registry Number®

5965-09-3

CAS Name

Phenol, 4,4′-(1,2-diethyl-1,2-ethenediyl)bis-, bis(dihydrogen phosphate), disodium salt, (E)-

Molecular Formula

C18H22O8P2.2Na

Cite this Page

Phenol, 4,4′-(1,2-diethyl-1,2-ethenediyl)bis-, bis(dihydrogen phosphate), disodium salt, (E)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5965-09-3 (retrieved 2024-11-25) (CAS RN: 5965-09-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    230 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C18H22O8P2.2Na/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);;/b18-17+;;

InChIKey

InChIKey=HTSVVPYJXJSNMJ-QIKYXUGXSA-N

SMILES

C(=C(/CC)\C1=CC=C(OP(=O)(O)O)C=C1)(\CC)/C2=CC=C(OP(=O)(O)O)C=C2.[Na]

Canonical SMILES

[Na].O=P(O)(O)OC1=CC=C(C=C1)C(=C(C2=CC=C(OP(=O)(O)O)C=C2)CC)CC

Other Names for this Substance

  • Phenol, 4,4′-(1,2-diethyl-1,2-ethenediyl)bis-, bis(dihydrogen phosphate), disodium salt, (E)-
  • 4,4′-Stilbenediol, α,α′-diethyl-, bis(dihydrogen phosphate), disodium salt, (E)-
  • Diethylstilbestrol 4,4′-diphosphoric ester, disodium salt
  • Fosfestrol disodium salt

Deleted or Replaced CAS Registry Numbers

31025-38-4

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