![1-[(3S,8R,9S,10R,13S,14S,16S,17R)-3,17-dihydroxy-10,13,16-trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone (CAS: 13900-61-3) - Chemical Structure and Molecular Formula](/static/img/prod_pic/FT-0772730.png "1-[(3S,8R,9S,10R,13S,14S,16S,17R)-3,17-dihydroxy-10,13,16-trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone chemical structure")
1-[(3S,8R,9S,10R,13S,14S,16S,17R)-3,17-dihydroxy-10,13,16-trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Catalog No: FT-0772730
CAS No: 13900-61-3
- Chemical Name: 1-[(3S,8R,9S,10R,13S,14S,16S,17R)-3,17-dihydroxy-10,13,16-trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
- Molecular Formula: C22H34O3
- Molecular Weight: 346.5
- InChI Key: MDCCMZGGNCMFPQ-RGEWOSBMSA-N
- InChI: InChI=1S/C22H34O3/c1-13-11-19-17-6-5-15-12-16(24)7-9-20(15,3)18(17)8-10-21(19,4)22(13,25)14(2)23/h5,13,16-19,24-25H,6-12H2,1-4H3/t13-,16-,17+,18-,19-,20-,21-,22-/m0/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 |
| Product_Name: | 17alpha-hydroxy-16beta-methylpregnenolone |
|---|---|
| MF: | C22H34O3 |
| Bolling_Point: | 483.9ºC at 760mmHg |
| Density: | 1.13g/cm3 |
| FW: | 346.50400 |
| Melting_Point: | 224-230ºC |
| Flash_Point: | 260.6ºC |
| CAS: | 13900-61-3 |
| MF: | C22H34O3 |
|---|---|
| Bolling_Point: | 483.9ºC at 760mmHg |
| Exact_Mass: | 346.25100 |
| More_Info: | ['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）224-230 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用'] |
| Melting_Point: | 224-230ºC |
| Refractive_Index: | 1.561 |
| PSA: | 57.53000 |
| Flash_Point: | 260.6ºC |
| Density: | 1.13g/cm3 |
| Molecular_Structure: | ['1 . Molar refractive index 9857 ', '2 . Molar volume （m3/mol）3031 ', '3 . Parachor （902K）7954 ', '4 表面张力（30 dyne/cm）474 ', '5 . Polarizability （05 10 -24cm 3）3907'] |
| Computational_Chemistry: | ['1 . XlogP 33 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 1 ', '5 . TPSA 575 ', '6 . Heavy Atom Count 25 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 625 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 8 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1'] |
| FW: | 346.50400 |
| LogP: | 3.87620 |
| Vapor_Pressure: | 2.14E-11mmHg at 25°C |
| Safety_Statements: | 24/25 |
|---|
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