ChemicalBook--->CAS DataBase List--->407577-53-1

407577-53-1

407577-53-1 Structure

407577-53-1 Structure
IdentificationBack Directory
[Name]

7β-Fulvestrant
[CAS]

407577-53-1
[Synonyms]

7β-Fulvestrant
Fulvestrant IMpurity A
Fulvestrant EP impurity A
Fulvestrant EP impurity A -F
Fulvestrant EP Impurity A (7β-Fulvestrant)
Fulvestrant Impurity 1(Fulvestrant EP Impurity A)
Fulvestrant EP Impurity A (Fulvestrant beta-Isomer)
Estra-1,3,5(10)-triene-3,17-diol, 7-[9-[(4,4,5,5,5-pentafluoropentyl)sulfinyl]nonyl]-, (7β,17β)- (9CI)
(7S,8R,9S,13S,14S,17S)-13-methyl-7-(9-((4,4,5,5,5-pentafluoropentyl)sulfinyl)nonyl)-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
Fulvestrant impurity 1/Fulvestrant EP Impurity A/Fulvestrant beta-Isomer/(7S,8R,9S,13S,14S,17S)-13-Methyl-7-(9-((4,4,5,5,5-pentafluoropentyl)sulfinyl)nonyl)-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
[Molecular Formula]

C32H47F5O3S
[MDL Number]

MFCD24386695
[MOL File]

407577-53-1.mol
[Molecular Weight]

606.77
Chemical PropertiesBack Directory
[Melting point ]

67-71°C
[Boiling point ]

674.8±55.0 °C(Predicted)
[density ]

1.201±0.06 g/cm3(Predicted)
[storage temp. ]

-20°C Freezer
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

10.27±0.70(Predicted)
[color ]

White to Pale Beige
[InChIKey]

VWUXBMIQPBEWFH-MGXKXKJGNA-N
[SMILES]

c1cc2[C@@H]3CC[C@]4(C)[C@@H](O)CC[C@@H]4[C@@H]3[C@@H](CCCCCCCCCS(CCCC(F)(F)C(F)(F)F)=O)Cc2cc1O |&1:3,6,8,12,13,14,r|
Hazard InformationBack Directory
[Chemical Properties]

Off-White to Pale Beige Solid
[Uses]

Fulvestrant (F862500) impurity A. The S-isomer of Fulvestrant.
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