- InChI
- InChI=1S/C15H24O/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13,14)16/h8,10,12,14,16H,3,5-7,9H2,1-2,4H3
- InChI Key
- LZJKACCRRXUWAR-UHFFFAOYSA-N
- Formula
- C15H24O
- SMILES
- C=C1CCC2C(C)CC=C(C(C)C)C2(O)C1
- Molecular Weight1
- 220.35
- CAS
- 1005276-30-1
- 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° | 69.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -264.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.44 | kJ/mol | Joback Calculated Property |
| log10WS | -4.25 | Crippen Calculated Property | |
| logPoct/wat | 3.696 | Crippen Calculated Property | |
| McVol | 197.760 | ml/mol | McGowan Calculated Property |
| Pc | 2171.40 | kPa | Joback Calculated Property |
| Inp | 1645.60 | NIST | |
| Tboil | 663.77 | K | Joback Calculated Property |
| Tc | 870.50 | K | Joback Calculated Property |
| Tfus | 373.05 | K | Joback Calculated Property |
| Vc | 0.738 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [572.06; 671.99] | J/mol×K | [663.77; 870.50] | 
|
| Cp,gas | 572.06 | J/mol×K | 663.77 | Joback Calculated Property |
| Cp,gas | 590.64 | J/mol×K | 698.22 | Joback Calculated Property |
| Cp,gas | 608.29 | J/mol×K | 732.68 | Joback Calculated Property |
| Cp,gas | 625.13 | J/mol×K | 767.13 | Joback Calculated Property |
| Cp,gas | 641.29 | J/mol×K | 801.59 | Joback Calculated Property |
| Cp,gas | 656.87 | J/mol×K | 836.04 | Joback Calculated Property |
| Cp,gas | 671.99 | J/mol×K | 870.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dehydroxy-isocalamendiol.
Sources
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