- InChI
- InChI=1S/C15H24O/c1-10(2)12-7-9-15(4)8-5-6-11(3)13(15)14(12)16/h10,12H,5-9H2,1-4H3/t12-,15-/m0/s1
- InChI Key
- LRSNSCWFOBGPBP-WFASDCNBSA-N
- Formula
- C15H24O
- SMILES
- CC1=C2C(=O)C(C(C)C)CCC2(C)CCC1
- 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° | 28.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -324.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.82 | kJ/mol | Joback Calculated Property |
| log10WS | -4.30 | Crippen Calculated Property | |
| logPoct/wat | 4.128 | Crippen Calculated Property | |
| McVol | 197.760 | ml/mol | McGowan Calculated Property |
| Pc | 2058.62 | kPa | Joback Calculated Property |
| Inp | 1605.00 | NIST | |
| Tboil | 649.90 | K | Joback Calculated Property |
| Tc | 884.41 | K | Joback Calculated Property |
| Tfus | 383.53 | K | Joback Calculated Property |
| Vc | 0.743 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [561.93; 679.96] | J/mol×K | [649.90; 884.41] | 
|
| Cp,gas | 561.93 | J/mol×K | 649.90 | Joback Calculated Property |
| Cp,gas | 584.17 | J/mol×K | 688.99 | Joback Calculated Property |
| Cp,gas | 605.19 | J/mol×K | 728.07 | Joback Calculated Property |
| Cp,gas | 625.15 | J/mol×K | 767.16 | Joback Calculated Property |
| Cp,gas | 644.17 | J/mol×K | 806.24 | Joback Calculated Property |
| Cp,gas | 662.39 | J/mol×K | 845.33 | Joback Calculated Property |
| Cp,gas | 679.96 | J/mol×K | 884.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (-)-(7R,10S)-eudesm-4-en-6-one.
Sources
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