AC1L43NP
2-ethynyl-3a,5a-dimethyl-6-(1,2,2-trifluoroethenyl)-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]indene-2,6-diol
Also Known As: 2-Ethynyl-20,21,21-trifluoro-A-nor-17alpha-pregn-20-ene-2beta,17-diol|2-alpha-Ethynyl-20,21,21-trifluoro-A-nor-17-alpha-pregn-20-ene-2-beta,17-beta-diol|A-Nor-17-alpha-pregn-20-ene-2-beta,17-beta-diol, 2-alpha-ethynyl-20,21,21-trifluoro-|A-Norpregn-20-ene-2,17-diol, 2-ethynyl-20,21,21-trifluoro-, (2beta,17alpha)-|2-ethynyl-3a,5a-dimethyl-6-(1,2,2-trifluoroethenyl)-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]indene-2,6-diol|7-Ethynyl-8a,10a-dimethyl-1-(1,2,2-trifluoroethen-1-yl)hexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol|7-ethynyl-8a,10a-dimethyl-1-(trifluoroethenyl)hexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol|Dicyclopenta(a,f)naphthalene-1,7-diol, 7-ethynylhexadecahydro-8a,10a-dimethyl-1-(1,2,2-trifluoroethenyl)-, (1S,3aS,3bR,7R,8aS,8bS,10aS)-
| Molecular Formula | C22H29F3O2 |
|---|---|
| Molecular Weight | 382.21198 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.21198 |
| Monoisotopic Mass | 382.21198 |
| Heavy Atoms | 27 |
| Complexity | 737.0 |
Chemical Identifiers
| CAS Number | 52-47-1 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2(C(=C(F)F)F)O)CCC4C3(CC(C4)(C#C)O)C |
| InChIKey | WNWFNZCICMONRN-UHFFFAOYSA-N |
Product Overview
AC1L43NP (CAS 52-47-1), with molecular formula C22H29F3O2 and molecular weight 382.21198 g/mol. IUPAC: 2-ethynyl-3a,5a-dimethyl-6-(1,2,2-trifluoroethenyl)-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]indene-2,6-diol.