- InChI
- InChI=1S/C15H26/c1-5-15-9-12(2)6-13(3,10-15)8-14(4,7-12)11-15/h5-11H2,1-4H3/t12-,13+,14?,15?
- InChI Key
- XJPFDAWKYDBNOI-DGKWVBSXSA-N
- Formula
- C15H26
- SMILES
-
CCC12CC3(C)CC(C)(CC(C)(C3)C1)C
2 - Molecular Weight1
- 206.37
- 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).
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.4062 | Relay (... Calculated Property | |
| ΔfG° | 215.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -284.40 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 2.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.84 | kJ/mol | Relay (... Calculated Property |
| IE | 8.82 | eV | Relay (... Calculated Property |
| log10WS | -5.88 | Relay (... Calculated Property | |
| logPoct/wat | 4.783 | Crippen Calculated Property | |
| McVol | 189.630 | ml/mol | McGowan Calculated Property |
| Pc | 2276.24 | kPa | Joback Calculated Property |
| Inp | [1271.00; 1294.00] |
|
|
| Inp | 1271.00 | NIST | |
| Inp | 1285.00 | NIST | |
| Inp | 1294.00 | NIST | |
| Inp | 1271.00 | NIST | |
| Inp | 1285.00 | NIST | |
| Inp | 1294.00 | NIST | |
| Tboil | 527.44 | K | Relay (... Calculated Property |
| Tc | 748.61 | K | Relay (... Calculated Property |
| Tfus | 303.53 | K | Relay (... Calculated Property |
| Vc | 0.734 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [517.85; 638.51] | J/mol×K | [563.38; 796.14] |
|
| Cp,gas | 517.85 | J/mol×K | 563.38 | Joback Calculated Property |
| Cp,gas | 540.55 | J/mol×K | 602.17 | Joback Calculated Property |
| Cp,gas | 561.47 | J/mol×K | 640.97 | Joback Calculated Property |
| Cp,gas | 581.16 | J/mol×K | 679.76 | Joback Calculated Property |
| Cp,gas | 600.20 | J/mol×K | 718.55 | Joback Calculated Property |
| Cp,gas | 619.13 | J/mol×K | 757.34 | Joback Calculated Property |
| Cp,gas | 638.51 | J/mol×K | 796.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-ethyl-3,5,7-trimethyladamantane.
Sources
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