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Molecule
Testosterone
CAS: 58-22-0 · C19H28O2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 58-22-0
- Molecular Formula
- C19H28O2
- Molecular Mass
- 288.43 g/mol
Identifiers
CAS Registry Number
58-22-0
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O
InChI Key
MUMGGOZAMZWBJJ-DYKIIFRCSA-N
InChI
InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1
Names and Synonyms
- Testosterone Common Name
- Androst-4-en-3-one, 17-hydroxy-, (17β)- Synonym
- Testosterone Synonym
- (17β)-17-Hydroxyandrost-4-en-3-one Synonym
- Androlin Synonym
- Andronaq Synonym
- Androst-4-en-17β-ol-3-one Synonym
- Andrusol Synonym
- Geno-cristaux Gremy Synonym
- Homosteron Synonym
- Homosterone Synonym
- 17β-Hydroxy-Δ4-androsten-3-one Synonym
- 17β-Hydroxyandrost-4-en-3-one Synonym
- Mertestate Synonym
- Orquisteron Synonym
- Percutacrine androgenique Synonym
- Primotest Synonym
- Primoteston Synonym
- Teslen Synonym
- Testandrone Synonym
- Testiculosterone Synonym
- Testobase Synonym
- Testosteroid Synonym
- Testoviron Schering Synonym
- Testrone Synonym
- Testryl Synonym
- Virormone Synonym
- Virosterone Synonym
- 17β-Hydroxyandrost-4-ene-3-one Synonym
- Testosteron Synonym
- Cristerona T Synonym
- Testopropon Synonym
- Perandren Synonym
- Testoviron T Synonym
- Neotestis Synonym
- Δ4-Androsten-17β-ol-3-one Synonym
- 4-Androsten-3-one-17β-ol Synonym
- Androst-4-ene-17β-ol-3-one Synonym
- Testolent Synonym
- Testoderm Synonym
- Androderm Synonym
- CDB 111C Synonym
- Relibra Synonym
- AndroGel Synonym
- Viatrel Synonym
- Tostrelle Synonym
- Andro 100 Synonym
- Testolin Synonym
- Testro AQ Synonym
- Synandrol F Synonym
- Oreton Synonym
- CP 601B Synonym
- NSC 9700 Synonym
- Testim Synonym
- AA 2500 Synonym
- Andropatch Synonym
- Tostrex Synonym
- 17β-Testosterone Synonym
- COL 1621 Synonym
- Testogel Synonym
- Intrinsa Synonym
- Striant Synonym
- Opterone Synonym
- (+)-Testosterone Synonym
- Noseafix Synonym
- Glowmin Synonym
- Nasobol Synonym
- Compleo Synonym
- Testopatch Synonym
- Testopel Synonym
- Axiron Synonym
- AndroForte 5 Synonym
- (8R,9S,10R,13S,14S,17S)-17-Hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one Synonym
- Natesto Synonym
- Livensa Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 288.43 g/mol | CAS Common Chemistry |
| 288.431 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Testosterone | CAS Common Chemistry |
| Canonical SMILES | O=C1C=C2CCC3C(CCC4(C)C(O)CCC34)C2(C)CC1 | CAS Common Chemistry |
| InChI | InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=MUMGGOZAMZWBJJ-DYKIIFRCSA-N | CAS Common Chemistry |
| Melting Point | 155 °C | CAS Common Chemistry |
| Name | Testosterone | CAS Common Chemistry |
| Heavy Atom Count | 21 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | 3.879200000000003 | RDKit |
| 3.8792 | RDKit | |
| Molar Refractivity | 82.71680000000005 cm³/mol | RDKit |
| Ring Count | 4 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.8421 | RDKit |
| 0.84 | chempirical lib | |
| Exact Mass | 288.208930136 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
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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.
External Resources
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MW = 288.43 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C19H28O2.