- InChI
- InChI=1S/C24H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-24(25)26-22-23-19-16-15-17-20-23/h15-17,19-20H,2-14,18,21-22H2,1H3
- InChI Key
- XFIKDNCHPGLFLR-UHFFFAOYSA-N
- Formula
- C24H40O2
- SMILES
-
CCCCCCCCCCCCCCCCC(=O)OCc1ccccc
1 - Molecular Weight1
- 360.57
- CAS
- 74978-19-1
- Other Names
-
- Benzyl heptadecanoate
- 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 | 1.0483 | Relay (1.0) Calculated Property | |
| ΔfG° | -46.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -596.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.90 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.14 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.42 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.601 | Crippen Calculated Property | |
| McVol | 332.700 | ml/mol | McGowan Calculated Property |
| Pc | 985.16 | kPa | Joback Calculated Property |
| Tboil | 639.66 | K | Relay (1.0) Calculated Property |
| Tc | 849.87 | K | Relay (1.0) Calculated Property |
| Tfus | 296.78 | K | Relay (1.0) Calculated Property |
| Vc | 1.272 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1058.92; 1158.05] | J/mol×K | [833.62; 1025.50] | 
|
| Cp,gas | 1058.92 | J/mol×K | 833.62 | Joback Calculated Property |
| Cp,gas | 1078.29 | J/mol×K | 865.60 | Joback Calculated Property |
| Cp,gas | 1096.46 | J/mol×K | 897.58 | Joback Calculated Property |
| Cp,gas | 1113.47 | J/mol×K | 929.56 | Joback Calculated Property |
| Cp,gas | 1129.37 | J/mol×K | 961.54 | Joback Calculated Property |
| Cp,gas | 1144.21 | J/mol×K | 993.52 | Joback Calculated Property |
| Cp,gas | 1158.05 | J/mol×K | 1025.50 | Joback Calculated Property |
| η | [0.0000375; 0.0011099] | Pa×s | [428.99; 833.62] |
|
| η | 0.0011099 | Pa×s | 428.99 | Joback Calculated Property |
| η | 0.0004302 | Pa×s | 496.43 | Joback Calculated Property |
| η | 0.0002091 | Pa×s | 563.87 | Joback Calculated Property |
| η | 0.0001186 | Pa×s | 631.30 | Joback Calculated Property |
| η | 0.0000751 | Pa×s | 698.74 | Joback Calculated Property |
| η | 0.0000515 | Pa×s | 766.18 | Joback Calculated Property |
| η | 0.0000375 | Pa×s | 833.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heptadecanoic acid, phenylmethyl ester.
Sources
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