- InChI
- InChI=1S/C25H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-23-27-25(26)22-21-24-19-16-17-20-24/h24H,2-23H2,1H3
- InChI Key
- WJHIYBFCQQGWNY-UHFFFAOYSA-N
- Formula
- C25H48O2
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)CCC1CCC
C1 - Molecular Weight1
- 380.65
- 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).
- 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 | 1.0591 | Relay (1.0) Calculated Property | |
| ΔfG° | -114.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -841.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 58.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.34 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.75 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.13 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.371 | Crippen Calculated Property | |
| McVol | 359.690 | ml/mol | McGowan Calculated Property |
| Pc | 848.50 | kPa | Joback Calculated Property |
| Tboil | 652.09 | K | Relay (1.0) Calculated Property |
| Tc | 850.20 | K | Relay (1.0) Calculated Property |
| Tfus | 288.36 | K | Relay (1.0) Calculated Property |
| Vc | 1.372 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1204.86; 1318.47] | J/mol×K | [845.10; 1035.63] | 
|
| Cp,gas | 1204.86 | J/mol×K | 845.10 | Joback Calculated Property |
| Cp,gas | 1226.96 | J/mol×K | 876.85 | Joback Calculated Property |
| Cp,gas | 1247.73 | J/mol×K | 908.61 | Joback Calculated Property |
| Cp,gas | 1267.21 | J/mol×K | 940.36 | Joback Calculated Property |
| Cp,gas | 1285.46 | J/mol×K | 972.12 | Joback Calculated Property |
| Cp,gas | 1302.53 | J/mol×K | 1003.87 | Joback Calculated Property |
| Cp,gas | 1318.47 | J/mol×K | 1035.63 | Joback Calculated Property |
| η | [0.0000473; 0.0015228] | Pa×s | [424.74; 845.10] |
|
| η | 0.0015228 | Pa×s | 424.74 | Joback Calculated Property |
| η | 0.0005667 | Pa×s | 494.80 | Joback Calculated Property |
| η | 0.0002695 | Pa×s | 564.86 | Joback Calculated Property |
| η | 0.0001510 | Pa×s | 634.92 | Joback Calculated Property |
| η | 0.0000949 | Pa×s | 704.98 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 775.04 | Joback Calculated Property |
| η | 0.0000473 | Pa×s | 845.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Cyclopentylpropionic acid, heptadecyl ester.
Sources
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