AC1L65RW
[(1S,2R,7R,9R,11R,12S,15S,16S)-8,8-difluoro-2,16-dimethyl-15-pentacyclo[9.7.0.02,7.07,9.012,16]octadec-5-enyl] acetate
Also Known As: KST-1A4923|3-nitro-benzoic acid N'-formyl-hydrazide|(3s,3as,5as,5br,9ar,10ar,11ar,11bs)-10,10-difluoro-3a,5b-dimethyl-2,3,3a,4,5,5a,5b,6,7,10,10a,11,11a,11b-tetradecahydro-1h-cyclopenta[a]cyclopropa[k]phenanthren-3-yl acetate|(3s,3as,5as,5br,9ar,10ar,11ar,11bs)-10,10-difluoro-3a,5b-dim|[(1S,2R,7R,9R,11R,12S,15S,16S)-8,8-difluoro-2,16-dimethyl-15-pentacyclo[9.7.0.02,7.07,9.012,16]octadec-5-enyl] acetate
| Molecular Formula | C22H30F2O2 |
|---|---|
| Molecular Weight | 364.22137 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 364.22137 |
| Monoisotopic Mass | 364.22137 |
| Heavy Atoms | 26 |
| Complexity | 688.0 |
Chemical Identifiers
| CAS Number | 467-53-8 |
|---|---|
| SMILES | CC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]4[C@]5([C@@]3(CCC=C5)C)C4(F)F)C |
| InChIKey | SGMJHXMWTPRENE-WMXBUORTSA-N |
Product Overview
AC1L65RW (CAS 467-53-8), with molecular formula C22H30F2O2 and molecular weight 364.22137 g/mol. IUPAC: [(1S,2R,7R,9R,11R,12S,15S,16S)-8,8-difluoro-2,16-dimethyl-15-pentacyclo[9.7.0.02,7.07,9.012,16]octadec-5-enyl] acetate.