- InChI
- InChI=1S/C21H30O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h12,16-19H,4-11H2,1-3H3/t16?,17?,18?,19-,20?,21?/m1/s1
- InChI Key
- DJPZSBANTAQNFN-MTIYKSONSA-N
- Formula
- C21H30O3
- SMILES
-
CC(=O)OC1CCC2C3CCC4=CC(=O)CCC4
(C)C3CCC12C - Molecular Weight1
- 330.46
- CAS
- 1045-69-8
- Other Names
-
- 17«beta»-Acetoxy-4-androsten-3-one
- 17«beta»-Acetoxy-«DELTA»4-androstan-3-one
- 17«beta»-Hydroxyandrost-4-en-3-one acetate
- 17«beta»-Acetoxy-4-androsten-3-one
- 17«beta»-Acetoxy-«DELTA»4-androstan-3-one
- 17«beta»-Hydroxyandrost-4-en-3-one acetate
- 3-Oxoandrost-4-en-17«beta»-yl acetate
- 3-Oxoandrost-4-en-17«beta»-yl acetate
- Aceto-sterandryl
- Aceto-testoviron
- Amolisin
- Androst-4-en-17«beta»-ol-3-one acetate
- Androst-4-en-17«beta»-ol-3-one acetate
- Androst-4-en-3-one, 17-(acetyloxy)-, (17«beta»)-
- Androst-4-en-3-one, 17-(acetyloxy)-, (17«beta»)-
- Androtest A
- Deposteron
- Farmatest
- NSC 523836
- Perandrone A
- SKF 5647
- Testosterone 17-acetate
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5480 | Relay (... Calculated Property | |
| ΔfG° | -54.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -632.16 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 24.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.97 | kJ/mol | Relay (... Calculated Property |
| IE | 8.62 | eV | Relay (... Calculated Property |
| log10WS | [-5.18; -5.18] |
|
|
| log10WS | -5.18 | Aq. Sol... | |
| log10WS | -5.18 | Estimat... | |
| logPoct/wat | 4.450 | Crippen Calculated Property | |
| McVol | 268.020 | ml/mol | McGowan Calculated Property |
| Pc | 1648.43 | kPa | Joback Calculated Property |
| Tboil | 649.05 | K | Relay (... Calculated Property |
| Tc | 926.04 | K | Relay (... Calculated Property |
| Tfus | 391.66 | K | Relay (... Calculated Property |
| Vc | 0.954 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [945.49; 1111.01] | J/mol×K | [867.58; 1115.31] |
|
| Cp,gas | 945.49 | J/mol×K | 867.58 | Joback Calculated Property |
| Cp,gas | 971.99 | J/mol×K | 908.87 | Joback Calculated Property |
| Cp,gas | 998.46 | J/mol×K | 950.16 | Joback Calculated Property |
| Cp,gas | 1025.25 | J/mol×K | 991.45 | Joback Calculated Property |
| Cp,gas | 1052.70 | J/mol×K | 1032.74 | Joback Calculated Property |
| Cp,gas | 1081.18 | J/mol×K | 1074.03 | Joback Calculated Property |
| Cp,gas | 1111.01 | J/mol×K | 1115.31 | Joback Calculated Property |
| ΔfusH | 27.88 | kJ/mol | 413.00 | NIST |
Similar Compounds
Find more compounds similar to Testosterone acetate.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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