- InChI
- InChI=1S/C15H24O/c1-9(2)12-8-14-11(4)15(16-14)6-5-10(3)7-13(12)15/h7,9,11-14H,5-6,8H2,1-4H3/t11?,12-,13?,14-,15-/m1/s1
- InChI Key
- DWHKMTZSGDMQER-VIGLNQMMSA-N
- Formula
- C15H24O
- SMILES
- CC1=CC2C(C(C)C)CC3OC2(CC1)C3C
- Molecular Weight1
- 220.35
- 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° | 144.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -263.26 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.37 | kJ/mol | Joback Calculated Property |
| log10WS | -3.98 | Crippen Calculated Property | |
| logPoct/wat | 3.792 | Crippen Calculated Property | |
| McVol | 191.200 | ml/mol | McGowan Calculated Property |
| Pc | 2030.89 | kPa | Joback Calculated Property |
| Inp | 1550.00 | NIST | |
| Tboil | 592.91 | K | Joback Calculated Property |
| Tc | 812.06 | K | Joback Calculated Property |
| Tfus | 345.86 | K | Joback Calculated Property |
| Vc | 0.728 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [541.04; 657.94] | J/mol×K | [592.91; 812.06] | 
|
| Cp,gas | 541.04 | J/mol×K | 592.91 | Joback Calculated Property |
| Cp,gas | 563.43 | J/mol×K | 629.43 | Joback Calculated Property |
| Cp,gas | 584.42 | J/mol×K | 665.96 | Joback Calculated Property |
| Cp,gas | 604.18 | J/mol×K | 702.48 | Joback Calculated Property |
| Cp,gas | 622.90 | J/mol×K | 739.01 | Joback Calculated Property |
| Cp,gas | 640.76 | J/mol×K | 775.53 | Joback Calculated Property |
| Cp,gas | 657.94 | J/mol×K | 812.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,8-Epoxycadin-4-ene.
Sources
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