- InChI
- InChI=1S/C14H20/c1-10-13(2,3)11-6-8-14(10)7-4-5-12(14)9-11/h5,11H,1,4,6-9H2,2-3H3
- InChI Key
- UEWFRELXRTUKOE-UHFFFAOYSA-N
- Formula
- C14H20
- SMILES
- C=C1C23CCC=C2CC(CC3)C1(C)C
- Molecular Weight1
- 188.31
- 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° | 287.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 34.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.65 | kJ/mol | Joback Calculated Property |
| log10WS | -4.35 | Crippen Calculated Property | |
| logPoct/wat | 4.089 | Crippen Calculated Property | |
| McVol | 166.940 | ml/mol | McGowan Calculated Property |
| Pc | 2520.12 | kPa | Joback Calculated Property |
| Inp | [1369.00; 1369.00] |
|
|
| Inp | 1369.00 | NIST | |
| Inp | 1369.00 | NIST | |
| Tboil | 552.26 | K | Joback Calculated Property |
| Tc | 784.26 | K | Joback Calculated Property |
| Tfus | 369.08 | K | Joback Calculated Property |
| Vc | 0.640 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [431.06; 535.73] | J/mol×K | [552.26; 784.26] |
|
| Cp,gas | 431.06 | J/mol×K | 552.26 | Joback Calculated Property |
| Cp,gas | 451.40 | J/mol×K | 590.93 | Joback Calculated Property |
| Cp,gas | 470.15 | J/mol×K | 629.59 | Joback Calculated Property |
| Cp,gas | 487.63 | J/mol×K | 668.26 | Joback Calculated Property |
| Cp,gas | 504.17 | J/mol×K | 706.93 | Joback Calculated Property |
| Cp,gas | 520.10 | J/mol×K | 745.59 | Joback Calculated Property |
| Cp,gas | 535.73 | J/mol×K | 784.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dehydronigritene.
Sources
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