- InChI
- InChI=1S/C15H26O/c1-10(2)12-6-5-11(3)13-7-8-15(4,16)9-14(12)13/h9-13,16H,5-8H2,1-4H3/t11-,12-,13+,15-/m0/s1
- InChI Key
- IHEUASSNMSDWFX-XPCVCDNBSA-N
- Formula
- C15H26O
- SMILES
- CC(C)C1CCC(C)C2CCC(C)(O)C=C12
- Molecular Weight1
- 222.37
- 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.
- I : 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 | 0.5343 | Relay (... Calculated Property | |
| ΔfG° | 8.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -299.19 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 19.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.24 | kJ/mol | Relay (... Calculated Property |
| IE | 8.19 | eV | Relay (... Calculated Property |
| log10WS | -4.32 | Relay (... Calculated Property | |
| logPoct/wat | 3.776 | Crippen Calculated Property | |
| McVol | 202.060 | ml/mol | McGowan Calculated Property |
| Pc | 2069.88 | kPa | Joback Calculated Property |
| Inp | [1549.00; 1555.00] |
|
|
| Inp | 1550.00 | NIST | |
| Inp | 1550.00 | NIST | |
| Inp | 1549.00 | NIST | |
| Inp | 1549.00 | NIST | |
| Inp | Outlier 1555.00 | NIST | |
| Inp | 1550.00 | NIST | |
| I | 2215.00 | NIST | |
| Tboil | 559.12 | K | Relay (... Calculated Property |
| Tc | 782.81 | K | Relay (... Calculated Property |
| Tfus | 351.18 | K | Relay (... Calculated Property |
| Vc | 0.713 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [597.80; 704.93] | J/mol×K | [659.94; 865.11] |
|
| Cp,gas | 597.80 | J/mol×K | 659.94 | Joback Calculated Property |
| Cp,gas | 617.79 | J/mol×K | 694.13 | Joback Calculated Property |
| Cp,gas | 636.77 | J/mol×K | 728.33 | Joback Calculated Property |
| Cp,gas | 654.86 | J/mol×K | 762.52 | Joback Calculated Property |
| Cp,gas | 672.18 | J/mol×K | 796.72 | Joback Calculated Property |
| Cp,gas | 688.83 | J/mol×K | 830.91 | Joback Calculated Property |
| Cp,gas | 704.93 | J/mol×K | 865.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Muurola-5-en-4-«beta»-ol.
Sources
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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.