- InChI
- InChI=1S/C15H26O2/c1-9(2)15-8-7-10(3)12-6-5-11(4)14(13(12)15)16-17-15/h9-14H,5-8H2,1-4H3/t10-,11-,12+,13-,14?,15+/m0/s1
- InChI Key
- HPLUFHNNBOHIAJ-PNJKBWKFSA-N
- Formula
- C15H26O2
- SMILES
- CC1CCC2(C(C)C)OOC3C(C)CCC1C32
- Molecular Weight1
- 238.37
- 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 | 0.4348 | Relay (... Calculated Property | |
| ΔfG° | 18.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -304.23 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 32.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.83 | kJ/mol | Relay (... Calculated Property |
| IE | 8.43 | eV | Relay (... Calculated Property |
| log10WS | -4.85 | Relay (... Calculated Property | |
| logPoct/wat | 3.804 | Crippen Calculated Property | |
| McVol | 201.370 | ml/mol | McGowan Calculated Property |
| Pc | 1963.07 | kPa | Joback Calculated Property |
| Inp | [1485.00; 1485.00] |
|
|
| Inp | 1485.00 | NIST | |
| Inp | 1485.00 | NIST | |
| Tboil | 551.37 | K | Relay (... Calculated Property |
| Tc | 790.13 | K | Relay (... Calculated Property |
| Tfus | 358.06 | K | Relay (... Calculated Property |
| Vc | 0.739 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [600.90; 727.25] | J/mol×K | [615.32; 836.44] |
|
| Cp,gas | 600.90 | J/mol×K | 615.32 | Joback Calculated Property |
| Cp,gas | 625.04 | J/mol×K | 652.17 | Joback Calculated Property |
| Cp,gas | 647.72 | J/mol×K | 689.03 | Joback Calculated Property |
| Cp,gas | 669.11 | J/mol×K | 725.88 | Joback Calculated Property |
| Cp,gas | 689.38 | J/mol×K | 762.74 | Joback Calculated Property |
| Cp,gas | 708.70 | J/mol×K | 799.59 | Joback Calculated Property |
| Cp,gas | 727.25 | J/mol×K | 836.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (+)-(1R,4R,6R,7R,10S)-Muurolan-4,7-peroxide.
Sources
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