- InChI
- InChI=1S/C24H46O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-21-23-26-24(25)22-20-8-6-4-2/h20,22H,3-19,21,23H2,1-2H3/b22-20+
- InChI Key
- RFYKKCCZKLVYTM-LSDHQDQOSA-N
- Formula
- C24H46O2
- SMILES
- CCCCC=CC(=O)OCCCCCCCCCCCCCCCCC
- Molecular Weight1
- 366.62
- 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.
- 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 | 1.0721 | Relay (1.0) Calculated Property | |
| ΔfG° | -2.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -763.82 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 60.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.71 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.29 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.147 | Crippen Calculated Property | |
| McVol | 352.160 | ml/mol | McGowan Calculated Property |
| Pc | 852.97 | kPa | Joback Calculated Property |
| Inp | [2662.00; 2662.00] |
|
|
| Inp | 2662.00 | NIST | |
| Inp | 2662.00 | NIST | |
| Tboil | 617.40 | K | Relay (1.0) Calculated Property |
| Tc | 808.56 | K | Relay (1.0) Calculated Property |
| Tfus | 293.87 | K | Relay (1.0) Calculated Property |
| Vc | 1.357 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1131.61; 1242.15] | J/mol×K | [828.97; 1015.16] |
|
| Cp,gas | 1131.61 | J/mol×K | 828.97 | Joback Calculated Property |
| Cp,gas | 1152.63 | J/mol×K | 860.00 | Joback Calculated Property |
| Cp,gas | 1172.54 | J/mol×K | 891.03 | Joback Calculated Property |
| Cp,gas | 1191.40 | J/mol×K | 922.06 | Joback Calculated Property |
| Cp,gas | 1209.26 | J/mol×K | 953.09 | Joback Calculated Property |
| Cp,gas | 1226.16 | J/mol×K | 984.13 | Joback Calculated Property |
| Cp,gas | 1242.15 | J/mol×K | 1015.16 | Joback Calculated Property |
| η | [0.0000364; 0.0009923] | Pa×s | [427.32; 828.97] |
|
| η | 0.0009923 | Pa×s | 427.32 | Joback Calculated Property |
| η | 0.0003939 | Pa×s | 494.26 | Joback Calculated Property |
| η | 0.0001949 | Pa×s | 561.20 | Joback Calculated Property |
| η | 0.0001121 | Pa×s | 628.14 | Joback Calculated Property |
| η | 0.0000717 | Pa×s | 695.09 | Joback Calculated Property |
| η | 0.0000496 | Pa×s | 762.03 | Joback Calculated Property |
| η | 0.0000364 | Pa×s | 828.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Heptenoic acid, heptadecyl ester.
Sources
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