EINECS 262-498-8
[2-[(2S,8R,10S,11S,14R,15S)-4-bromo-8-fluoro-14-hydroxy-2,15-dimethyl-5-oxo-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadeca-3,6-dien-14-yl]-2-oxoethyl] acetate
Also Known As: EINECS 262-498-8|2-Bromo-9beta,11beta-epoxy-6beta-fluoro-17,21-dihydroxypregna-1,4-diene-3,20-dione 21-acetate|2-Bromo-6-fluoro-17-hydroxy-3,20-dioxo-9,11-epoxypregna-1,4-dien-21-yl acetate|(9xi)-2-Bromo-6beta-fluoro-17-hydroxy-3,20-dioxo-9,11-epoxypregna-1,4-dien-21-yl acetate
| Molecular Formula | C23H26BrFO6 |
|---|---|
| Molecular Weight | 496.0897 g/mol |
| LogP | 2.9595 |
| Topological Polar Surface Area | 93.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 496.0897 |
| Monoisotopic Mass | 496.0897 |
| Heavy Atoms | 31 |
| Complexity | 975.1135 |
Chemical Identifiers
| CAS Number | 60864-69-9 |
|---|---|
| SMILES | CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC3C4([C@H]2C[C@H](C5=CC(=O)C(=C[C@@]54C)Br)F)O3)C)O |
Product Overview
EINECS 262-498-8 (CAS 60864-69-9), with molecular formula C23H26BrFO6 and molecular weight 496.0897 g/mol. IUPAC: [2-[(2S,8R,10S,11S,14R,15S)-4-bromo-8-fluoro-14-hydroxy-2,15-dimethyl-5-oxo-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadeca-3,6-dien-14-yl]-2-oxoethyl] acetate.
EINECS 262-498-8 is a custom synthesis product. We offer services from milligram to kilogram scale.
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