Back to Search
17Β-Hydroxy-17-Methyl-2-Oxa-5Α-Androstan-3-One
CAS: 53-39-4 | C19H30O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
53-39-4
Molecular Formula:
C19H30O3
Molecular Mass:
306.45 g/mol
Names and Synonyms:
17Β-Hydroxy-17-Methyl-2-Oxa-5Α-Androstan-3-One
Cyclopenta[5,6]naphtho[1,2-c]pyran-2(1H)-one, tetradecahydro-7-hydroxy-4a,6a,7-trimethyl-, (4aS,4bS,6aS,7S,9aS,9bR,11aS)-
2-Oxa-5α-androstan-3-one, 17β-hydroxy-17-methyl-
2-Oxaandrostan-3-one, 17-hydroxy-17-methyl-, (5α,17β)-
(4aS,4bS,6aS,7S,9aS,9bR,11aS)-Tetradecahydro-7-hydroxy-4a,6a,7-trimethylcyclopenta[5,6]naphtho[1,2-c]pyran-2(1H)-one
SC 11585
Anavar
17-Methyl-2-oxa-5α-androstan-17β-ol-3-one
Oxandrolone
17β-Hydroxy-17-methyl-2-oxa-5α-androstan-3-one
17β-Hydroxy-17α-methyl-2-oxa-5α-androstan-3-one
Vasorome
8075CB
Protivar
Oxandrin
Oxandren
Lonavar
NSC 67068
Provitar
(17β)-Oxandrolone
Identifiers:
SMILES:
C[C@]12COC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O
InChI:
InChI=1S/C19H30O3/c1-17-11-22-16(20)10-12(17)4-5-13-14(17)6-8-18(2)15(13)7-9-19(18,3)21/h12-15,21H,4-11H2,1-3H3/t12-,13+,14-,15-,17-,18-,19-/m0/s1
Key Properties
Melting Point
235-238 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 306.45 g/mol | CAS Common Chemistry |
| 306.446 g/mol | RDKit | |
| 306.21949481999997 g/mol | RDKit | |
| Canonical SMILES | O=C1OCC2(C)C(C1)CCC3C2CCC4(C)C3CCC4(O)C | CAS Common Chemistry |
| InChI | InChI=1S/C19H30O3/c1-17-11-22-16(20)10-12(17)4-5-13-14(17)6-8-18(2)15(13)7-9-19(18,3)21/h12-15,21H,4-11H2,1-3H3/t12-,13+,14-,15-,17-,18-,19-/m0/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=QSLJIVKCVHQPLV-PEMPUTJUSA-N | CAS Common Chemistry |
| Melting Point | 235-238 °C | CAS Common Chemistry |
| Name | 17β-Hydroxy-17-methyl-2-oxa-5α-androstan-3-one | CAS Common Chemistry |
| Heavy Atom Count | 22 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 46.53 Ų | RDKit |
| LogP | 3.543100000000003 | RDKit |
| Molar Refractivity | 84.07580000000006 | RDKit |
