(6α,11β)-6,9-Difluoro-11,17,21-trihydroxypregna-1,4-diene-3,20-dione
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(6α,11β)-6,9-Difluoro-11,17,21-trihydroxypregna-1,4-diene-3,20-dione
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CAS No:
806-29-1
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Formula:
C21H26F2O5
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Chemical Name:
(6α,11β)-6,9-Difluoro-11,17,21-trihydroxypregna-1,4-diene-3,20-dione
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Synonyms:
Pregna-1,4-diene-3,20-dione,6,9-difluoro-11,17,21-trihydroxy-,(6α,11β)-;Pregna-1,4-diene-3,20-dione,6α,9-difluoro-11β,17,21-trihydroxy-;(6α,11β)-6,9-Difluoro-11,17,21-trihydroxypregna-1,4-diene-3,20-dione;6α,9-Difluoroprednisolone;6α,9α-Difluoroprednisolone;NSC 77021
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CAS No:
(6α,11β)-6,9-Difluoro-11,17,21-trihydroxypregna-1,4-diene-3,20-dione Basic Attributes
396.4249464
396.42
212-360-8
77021
2937210000
Characteristics
94.8
1.12
1.4±0.1 g/cm3
250-257 °C (decomp)
568.3±50.0 °C at 760 mmHg
297.5±30.1 °C
1.587
Computed Properties
Molecular Weight:396.4
XLogP3:1.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:396.17483025
Monoisotopic Mass:396.17483025
Topological Polar Surface Area:94.8
Heavy Atom Count:28
Complexity:809
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(6α,11β)-6,9-Difluoro-11,17,21-trihydroxypregna-1,4-diene-3,20-dione
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