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4-Fluoro-19-nortestosterone

CAT: 0572-TRC-F597745-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F597745-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1881-31-8
Hazard Statement
No Data Available
Smiles
C[C@]12CC[C@H]3[C@@H](CCC4=C(F)C(=O)CC[C@H]34)[C@@H]1CC[C@@H]2O
Molecular Formula
C18 H25 F O2
Molecular Weight
292.388
InChI
InChI=1S/C18H25FO2/c1-18-9-8-11-10-4-6-15(20)17(19)13(10)3-2-12(11)14(18)5-7-16(18)21/h10-12,14,16,21H,2-9H2,1H3/t10-,11-,12-,14+,16+,18+/m1/s1
Additionnal Information
IUPAC name: (8R,9S,10R,13S,14S,17S)-4-fluoro-17-hydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Shipping Conditions
Room Temperature

Chemical Information

4-Fluoro-19-nortestosterone

inhibits steroid delta-isomerase

CAS Number1881-31-8
PubChem CID150947
IUPAC Name(8R,9S,10R,13S,14S,17S)-4-fluoro-17-hydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Molecular FormulaC18H25FO2
Molecular Weight292.4
XLogP2.9
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count21
Formal Charge0
Complexity511
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C(C(=O)CC[C@H]34)F
InChI
InChI=1S/C18H25FO2/c1-18-9-8-11-10-4-6-15(20)17(19)13(10)3-2-12(11)14(18)5-7-16(18)21/h10-12,14,16,21H,2-9H2,1H3/t10-,11-,12-,14+,16+,18+/m1/s1
InChIKey
KIUHHFFZDPMQQM-YGRHGMIBSA-N
Chemical Structure
2D Structure
2D structure of 4-Fluoro-19-nortestosterone
CAS: 1881-31-8
CID: 150947
Formula: C18H25FO2
MW: 292.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.4
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass292.18385820
Monoisotopic Mass292.18385820
Topological Polar Surface Area37.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity511
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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