- InChI
- InChI=1S/C23H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-22-19-17-20-23(24)21-22/h10-11,13-14,17,19-21,24H,2-9,12,15-16,18H2,1H3/b11-10-,14-13-
- InChI Key
- XARVWPSKIOWJCB-XVTLYKPTSA-N
- Formula
- C23H36O
- SMILES
- CCCCCCCCCC=CCC=CCCCc1cccc(O)c1
- Molecular Weight1
- 328.53
- CAS
- 448252-12-8
- 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).
- 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° | 261.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -224.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.00 | kJ/mol | Joback Calculated Property |
| log10WS | -7.81 | Crippen Calculated Property | |
| logPoct/wat | 7.358 | Crippen Calculated Property | |
| McVol | 308.440 | ml/mol | McGowan Calculated Property |
| Pc | 1238.09 | kPa | Joback Calculated Property |
| Inp | [2674.50; 2674.50] |
|
|
| Inp | 2674.50 | NIST | |
| Inp | 2674.50 | NIST | |
| Tboil | 841.26 | K | Joback Calculated Property |
| Tc | 1043.92 | K | Joback Calculated Property |
| Tfus | 476.95 | K | Joback Calculated Property |
| Vc | 1.141 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [965.87; 1069.83] | J/mol×K | [841.26; 1043.92] |
|
| Cp,gas | 965.87 | J/mol×K | 841.26 | Joback Calculated Property |
| Cp,gas | 984.67 | J/mol×K | 875.04 | Joback Calculated Property |
| Cp,gas | 1002.72 | J/mol×K | 908.81 | Joback Calculated Property |
| Cp,gas | 1020.15 | J/mol×K | 942.59 | Joback Calculated Property |
| Cp,gas | 1037.06 | J/mol×K | 976.37 | Joback Calculated Property |
| Cp,gas | 1053.58 | J/mol×K | 1010.14 | Joback Calculated Property |
| Cp,gas | 1069.83 | J/mol×K | 1043.92 | Joback Calculated Property |
| η | [0.0000026; 0.0002364] | Pa×s | [476.95; 841.26] |
|
| η | 0.0002364 | Pa×s | 476.95 | Joback Calculated Property |
| η | 0.0000728 | Pa×s | 537.67 | Joback Calculated Property |
| η | 0.0000285 | Pa×s | 598.39 | Joback Calculated Property |
| η | 0.0000132 | Pa×s | 659.11 | Joback Calculated Property |
| η | 0.0000070 | Pa×s | 719.82 | Joback Calculated Property |
| η | 0.0000041 | Pa×s | 780.54 | Joback Calculated Property |
| η | 0.0000026 | Pa×s | 841.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-((4Z,7Z)-Heptadeca-4,7-dien-1-yl)phenol.
Sources
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