ALPHA-CORTOLONE
Catalog No: FT-0632269
CAS No: 516-42-7
- Chemical Name: ALPHA-CORTOLONE
- Molecular Formula: C21H34O5
- Molecular Weight: 366.5
- InChI Key: JXCOSKURGJMQSG-AZQJGLEESA-N
- InChI: InChI=1S/C21H34O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-15,17-18,22-23,25-26H,3-11H2,1-2H3/t12-,13-,14+,15+,17+,18-,19+,20+,21+/m1/s1
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | N/A |
|---|---|
| CAS: | 516-42-7 |
| MF: | C21H34O5 |
| Flash_Point: | 309ºC |
| Product_Name: | (3R,5R,8S,9S,10S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-3,17-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-11-one |
| Density: | 1.248g/cm3 |
| FW: | 366.49200 |
| Bolling_Point: | 564.1ºC at 760mmHg |
| Refractive_Index: | 1.576 |
|---|---|
| MF: | C21H34O5 |
| Flash_Point: | 309ºC |
| LogP: | 1.65330 |
| FW: | 366.49200 |
| Density: | 1.248g/cm3 |
| PSA: | 97.99000 |
| Bolling_Point: | 564.1ºC at 760mmHg |
| Computational_Chemistry: | ['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :4 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :3 ', '6. TPSA :98 ', '7. Heavy Atom Count :26 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :593 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :9 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Exact_Mass: | 366.24100 |
