- InChI
- InChI=1S/C15H26/c1-4-14-7-12-6-13(3,9-14)10-15(5-2,8-12)11-14/h12H,4-11H2,1-3H3/t12-,13+,14?,15?
- InChI Key
- YENQWKFWURXCBW-DGKWVBSXSA-N
- Formula
- C15H26
- SMILES
- CCC12CC3CC(C)(C1)CC(CC)(C3)C2
- Molecular Weight1
- 206.37
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 221.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -115.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.13 | kJ/mol | Joback Calculated Property |
| log10WS | -4.82 | Crippen Calculated Property | |
| logPoct/wat | 4.783 | Crippen Calculated Property | |
| McVol | 189.630 | ml/mol | McGowan Calculated Property |
| Pc | 2181.56 | kPa | Joback Calculated Property |
| Inp | [1384.00; 1384.00] |
|
|
| Inp | 1384.00 | NIST | |
| Inp | 1384.00 | NIST | |
| Inp | 1384.00 | NIST | |
| Tboil | 563.14 | K | Joback Calculated Property |
| Tc | 786.58 | K | Joback Calculated Property |
| Tfus | 376.57 | K | Joback Calculated Property |
| Vc | 0.732 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [518.98; 638.53] | J/mol×K | [563.14; 786.58] |
|
| Cp,gas | 518.98 | J/mol×K | 563.14 | Joback Calculated Property |
| Cp,gas | 541.76 | J/mol×K | 600.38 | Joback Calculated Property |
| Cp,gas | 562.86 | J/mol×K | 637.62 | Joback Calculated Property |
| Cp,gas | 582.68 | J/mol×K | 674.86 | Joback Calculated Property |
| Cp,gas | 601.64 | J/mol×K | 712.10 | Joback Calculated Property |
| Cp,gas | 620.12 | J/mol×K | 749.34 | Joback Calculated Property |
| Cp,gas | 638.53 | J/mol×K | 786.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-diethyl-5-methyladamantane.
Sources
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