- InChI
- InChI=1S/C15H24O/c1-9(2)15-13-7-10(3)5-6-12(13)11(4)8-14(15)16/h7,9,13-16H,5-6,8H2,1-4H3/t13?,14-,15?/m0/s1
- InChI Key
- VAVHKURKIQXFJX-SLTAFYQDSA-N
- Formula
- C15H24O
- SMILES
- CC1=CC2C(=C(C)CC(O)C2C(C)C)CC1
- Molecular Weight1
- 220.35
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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 | 0.4740 | Relay (1.0) Calculated Property | |
| ΔfG° | 32.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -170.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.27 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.47 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.696 | Crippen Calculated Property | |
| McVol | 197.760 | ml/mol | McGowan Calculated Property |
| Pc | 2058.62 | kPa | Joback Calculated Property |
| Inp | [1678.00; 1680.00] |
|
|
| Inp | 1680.00 | NIST | |
| Inp | 1678.00 | NIST | |
| I | 2302.00 | NIST | |
| Tboil | 561.79 | K | Relay (1.0) Calculated Property |
| Tc | 775.18 | K | Relay (1.0) Calculated Property |
| Tfus | 377.36 | K | Relay (1.0) Calculated Property |
| Vc | 0.667 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [576.36; 671.20] | J/mol×K | [673.49; 875.43] |
|
| Cp,gas | 576.36 | J/mol×K | 673.49 | Joback Calculated Property |
| Cp,gas | 594.63 | J/mol×K | 707.15 | Joback Calculated Property |
| Cp,gas | 611.87 | J/mol×K | 740.80 | Joback Calculated Property |
| Cp,gas | 628.11 | J/mol×K | 774.46 | Joback Calculated Property |
| Cp,gas | 643.39 | J/mol×K | 808.12 | Joback Calculated Property |
| Cp,gas | 657.74 | J/mol×K | 841.77 | Joback Calculated Property |
| Cp,gas | 671.20 | J/mol×K | 875.43 | Joback Calculated Property |
| η | [0.0001076; 0.0034789] | Pa×s | [361.27; 673.49] |
|
| η | 0.0034789 | Pa×s | 361.27 | Joback Calculated Property |
| η | 0.0013534 | Pa×s | 413.31 | Joback Calculated Property |
| η | 0.0006503 | Pa×s | 465.34 | Joback Calculated Property |
| η | 0.0003621 | Pa×s | 517.38 | Joback Calculated Property |
| η | 0.0002244 | Pa×s | 569.42 | Joback Calculated Property |
| η | 0.0001507 | Pa×s | 621.45 | Joback Calculated Property |
| η | 0.0001076 | Pa×s | 673.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cadina-1(10),4-dien-8«alpha»-ol.
Sources
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