- InChI
- InChI=1S/C15H24O2/c1-10(2)12-7-8-14(4)13(16)6-5-11(3)15(14,17)9-12/h11-12,17H,1,5-9H2,2-4H3
- InChI Key
- BMGSSZITOGSORO-UHFFFAOYSA-N
- Formula
- C15H24O2
- SMILES
-
C=C(C)C1CCC2(C)C(=O)CCC(C)C2(O
)C1 - Molecular Weight1
- 236.35
- CAS
- 97094-19-4
- Other Names
-
- (4S,4aR,6R,8aR)-4a-Hydroxy-4,8a-dimethyl-6-(prop-1-en-2-yl)octahydronaphthalen-1(2H)-one
- 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° | -58.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -416.46 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.91 | kJ/mol | Joback Calculated Property |
| log10WS | -3.67 | Crippen Calculated Property | |
| logPoct/wat | 3.099 | Crippen Calculated Property | |
| McVol | 203.630 | ml/mol | McGowan Calculated Property |
| Pc | 2267.57 | kPa | Joback Calculated Property |
| Inp | 1898.70 | NIST | |
| Tboil | 720.86 | K | Joback Calculated Property |
| Tc | 944.74 | K | Joback Calculated Property |
| Tfus | 433.25 | K | Joback Calculated Property |
| Vc | 0.759 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [631.25; 747.25] | J/mol×K | [720.86; 944.74] | 
|
| Cp,gas | 631.25 | J/mol×K | 720.86 | Joback Calculated Property |
| Cp,gas | 651.36 | J/mol×K | 758.17 | Joback Calculated Property |
| Cp,gas | 670.87 | J/mol×K | 795.49 | Joback Calculated Property |
| Cp,gas | 689.99 | J/mol×K | 832.80 | Joback Calculated Property |
| Cp,gas | 708.95 | J/mol×K | 870.11 | Joback Calculated Property |
| Cp,gas | 727.97 | J/mol×K | 907.42 | Joback Calculated Property |
| Cp,gas | 747.25 | J/mol×K | 944.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Corymbolone.
Sources
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