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Substance Name: 1-Fluorohexestrol
RN: 74536-79-1
InChIKey: WJHRTUIAPLGNMC-UHFFFAOYSA-N

Note

  • Estrogen-receptor-based agent for imaging of human breast tumors.

Molecular Formula

  • C18-H21-F-O2

Molecular Weight

  • 288.36
 
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Names and Synonyms

Name of Substance

  • 1-Fluorohexestrol

Synonym

  • 1-Fluoro-3,4-bis(4-hydroxyphenyl)hexane

Systematic Name

  • Phenol, 4,4'-(1-ethyl-2-(2-fluoroethyl)-1,2-ethanediyl)bis-, (R*,S*)-

Registry Numbers

CAS Registry Number

  • 74536-79-1

System Generated Number

  • 0074536791

Structure Descriptors

InChI

1S/C18H21FO2/c1-2-17(13-3-7-15(20)8-4-13)18(11-12-19)14-5-9-16(21)10-6-14/h3-10,17-18,20-21H,2,11-12H2,1H3

InChIKey

WJHRTUIAPLGNMC-UHFFFAOYSA-N

Smiles

C(CF)[C@@H]([C@@H](CC)c1ccc(cc1)O)c1ccc(cc1)O