Cat Number: INT875573663

(7a,17b)-7-(9-Bromononyl)-estra-1,3,5(10)-triene-3,17-diol 17-acetate

APIs
CAS Number
875573-66-3
Synonyms
Estra-1,3,5(10)-triene-3,17-diol,7-(9-broMononyl)-,17-acetate,(7a,17b)-;(7R,8R,9S,13S,14S,17S)-7-(9-Bromononyl)-3-hydroxy-13-methyl-7,8,9,11, 12,13,14,15,16,17-decahydro;(7a,17b)-7-(9-BroMononyl)-estra-1,3,5(1)-triene-3,17-diol 17-acetate;(7R,8R,9S,13S,14S,17S)-7-(9-BroMononyl)-3-hydroxy-13-Methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-yl acetate;FULVESTRANT INTERMEDIATES--5(N-3);Fulvestrant Intermediates-5(N-3);(7R,8R,9S,13S,14S,17S)-7-(9-Bromononyl)-3-hydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahyd
Description
(7a,17b)-7-(9-Bromononyl)-estra-1,3,5(10)-triene-3,17-diol 17-acetate is an intermediate in the preparation of the breast cancer drug fulvestrant.
Molecular Weight
519.55
Molecular Formula
C29H43BrO3
EINECS
251-228-4
InChI
KFPTYJLFIUUHEJ-DFEBPFGKNA-N
InChIKey
KFPTYJLFIUUHEJ-DFEBPFGKNA-N
SMILES
C1(O)=CC2=C(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)C)CC3)[C@H](CCCCCCCCCBr)C2 |&1:7,9,11,13,17,24,r|
Storage
2-8 ℃
pKa
10.26±0.70(Predicted)
Boiling Point
593.3±50.0 ℃(Predicted)
Density, g/cm3
1.22
Applications
Fulvestrant intermediates
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