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Home > Encyclopedia > 2,4-dibromo-17-ethynyl(6,7)estradiol

2,4-dibromo-17-ethynyl(6,7)estradiol

2,4-dibromo-17-ethynyl(6,7)estradiol structure

2,4-dibromo-17-ethynyl(6,7)estradiol 

structure
  • CAS No:

    79769-52-1

  • Formula:

    C20H22Br2O2

  • Chemical Name:

    2,4-dibromo-17-ethynyl(6,7)estradiol

  • Synonyms:

    2,4-dibromo-17-ethynyl(6,7)estradiol;2,4-dibromo-17-ethynyl(6,7-3H)estradiol;3H-2,4-DBEE2;2,4-Dibromoethynylestradiol;DTXSID301000725;2,4-Dibromo-19-norpregna-1(10),2,4-trien-20-yne-3,17-diol;19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 2,4-dibromo-, (17alpha)-

2,4-dibromo-17-ethynyl(6,7)estradiol Basic Attributes

454.19548

453.997

Characteristics

40.5

5.1

180 - 181 °C (hexane)

Drug Information

2,4-dibromo-17-ethynyl(6,7)estradiol

Computed Properties

Molecular Weight:454.2
XLogP3:5.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:453.99661
Monoisotopic Mass:451.99866
Topological Polar Surface Area:40.5
Heavy Atom Count:24
Complexity:571
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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