[(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet
TL;DR: [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet (CAS 1993-22-2) is a chemical compound with molecular formula C25H31F3O5 and molecular weight 468.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroethylidene)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
Also Known As: [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet
| Molecular Formula | C25H31F3O5 |
|---|---|
| Molecular Weight | 468.21 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 468.21237 |
| Heavy Atoms | 33 |
| Complexity | 948.0 |
Chemical Identifiers
| CAS Number | 1993-22-2 |
|---|---|
| SMILES | CC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)C(=C(C(F)(F)F)OC(=O)C)C[C@]34C)C |
| InChIKey | WRDQUHFWTDMKQB-VKRTUVFGSA-N |
Product Overview
[(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet (CAS 1993-22-2), with molecular formula C25H31F3O5 and molecular weight 468.21 g/mol. IUPAC: [(8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroethylidene)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate.
Chemical Property Profile of [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet
Property Insights of [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet
The XLogP value of 4.8 indicates that [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet. Following Lipinski's Rule of Five, [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet?
The CAS number of [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet is 1993-22-2.
What is the molecular formula of [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet?
The molecular formula of [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet is C25H31F3O5.
What is the molecular weight of [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet?
The molecular weight of [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet is 468.21 g/mol.
Where can I buy [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet?
You can request a quote for [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet?
Yes, KEHONG BIO provides custom synthesis services for [(2Z,8R,9S,10R,13S,14S,17S)-2-(1-acetyloxy-2,2,2-trifluoroet and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.