Back to Search
Methenolone Acetate
CAS: 434-05-9 | C22H32O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
434-05-9
Molecular Formula:
C22H32O3
Molecular Mass:
344.50 g/mol
Names and Synonyms:
Methenolone Acetate
Androst-1-en-3-one, 17-(acetyloxy)-1-methyl-, (5α,17β)-
5α-Androst-1-en-3-one, 17β-hydroxy-1-methyl-, acetate
(5α,17β)-17-(Acetyloxy)-1-methylandrost-1-en-3-one
SH 567
SH 567a
SQ 16496
17β-Hydroxy-1-methyl-5α-androst-1-en-3-one acetate
Methenolone acetate
1-Methyl-5α-androst-1-en-17β-ol-3-one acetate
Nibal
Primobolan
Metenolone acetate
Primobolone
1-Methyl-17β-hydroxy-5α-androst-1-en-3-one acetate
1-Methyl-17β-hydroxy-5α-androst-1-en-3-one-17β-acetate
Primonabol
NSC 74226
Methenolone 17-acetate
Primobolan Tablets
Identifiers:
SMILES:
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)C=C(C)[C@]4(C)[C@H]3CC[C@]12C
InChI:
InChI=1S/C22H32O3/c1-13-11-16(24)12-15-5-6-17-18-7-8-20(25-14(2)23)21(18,3)10-9-19(17)22(13,15)4/h11,15,17-20H,5-10,12H2,1-4H3/t15-,17-,18-,19-,20-,21-,22-/m0/s1
Key Properties
Melting Point
138-139 °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 | 344.50 g/mol | CAS Common Chemistry |
| 344.4950000000001 g/mol | RDKit | |
| 344.23514488399996 g/mol | RDKit | |
| Canonical SMILES | O=C(OC1CCC2C3CCC4CC(=O)C=C(C)C4(C)C3CCC12C)C | CAS Common Chemistry |
| InChI | InChI=1S/C22H32O3/c1-13-11-16(24)12-15-5-6-17-18-7-8-20(25-14(2)23)21(18,3)10-9-19(17)22(13,15)4/h11,15,17-20H,5-10,12H2,1-4H3/t15-,17-,18-,19-,20-,21-,22-/m0/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=PGAUJQOPTMSERF-QWQRBHLCSA-N | CAS Common Chemistry |
| Melting Point | 138-139 °C | CAS Common Chemistry |
| Name | Methenolone acetate | CAS Common Chemistry |
| Heavy Atom Count | 25 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 43.370000000000005 Ų | RDKit |
| LogP | 4.696000000000004 | RDKit |
| Molar Refractivity | 96.81100000000006 | RDKit |
