- InChI
- InChI=1S/C15H18O2/c1-10-5-4-6-11(2)9-14-13(8-7-10)12(3)15(16)17-14/h5,8-9,14H,3-4,6-7H2,1-2H3/b10-5-,11-9+,13-8-/t14-/m0/s1
- InChI Key
- XBKBURWTMWWJNA-YHACVWLESA-N
- Formula
- C15H18O2
- SMILES
-
C=C1C(=O)OC2C=C(C)CCC=C(C)CC=C
12 - Molecular Weight1
- 230.30
- 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 | 0.3592 | Relay (1.0) Calculated Property | |
| ΔfG° | 25.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -176.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.37 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.87 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.471 | Crippen Calculated Property | |
| McVol | 190.730 | ml/mol | McGowan Calculated Property |
| Pc | 2306.95 | kPa | Joback Calculated Property |
| Inp | 1963.00 | NIST | |
| Tboil | 583.46 | K | Relay (1.0) Calculated Property |
| Tc | 796.75 | K | Relay (1.0) Calculated Property |
| Tfus | 374.40 | K | Relay (1.0) Calculated Property |
| Vc | 0.624 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [533.32; 628.39] | J/mol×K | [696.99; 944.49] | 
|
| Cp,gas | 533.32 | J/mol×K | 696.99 | Joback Calculated Property |
| Cp,gas | 552.91 | J/mol×K | 738.24 | Joback Calculated Property |
| Cp,gas | 571.02 | J/mol×K | 779.49 | Joback Calculated Property |
| Cp,gas | 587.63 | J/mol×K | 820.74 | Joback Calculated Property |
| Cp,gas | 602.74 | J/mol×K | 861.99 | Joback Calculated Property |
| Cp,gas | 616.33 | J/mol×K | 903.24 | Joback Calculated Property |
| Cp,gas | 628.39 | J/mol×K | 944.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dehydrocostunolide.
Sources
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