CAS
851962-14-6 Purity
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851962-14-6 Purity
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Tipredane
CAS
85197-77-9
Catalog Number
ACM85197779
Category
Other Products
Molecular Weight
410.615
Molecular Formula
C22H31FO2S2
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Specification
Synonyms
TIPREDANE, SQ-27239, Tipredane (USAN), AC1OCETW, CHEMBL1908322, 85197-77-9, D06161, (8S,9R,10S,11S,13S,14S,17R)-17-ethylsulfanyl-9-fluoro-11-hydroxy-10,13-dimethyl-17-methylsulfanyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
IUPAC Name
(8S,9R,10S,11S,13S,14S,17R)-17-ethylsulfanyl-9-fluoro-11-hydroxy-10,13-dimethyl-17-methylsulfanyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
SMILES
CCSC1(CCC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)SC
InChI Key
DXEXNWDGDYUITL-FXSSSKFRSA-N
Boiling Point
545ºC at 760 mmHg
Flash Point
283.4ºC
Density
1.23g/cm³
Exact Mass
410.17500
H-Bond Acceptor
5
H-Bond Donor
1
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