- InChI
- InChI=1S/C17H34O2/c1-3-5-7-9-10-11-13-15-17(18)19-16-14-12-8-6-4-2/h3-16H2,1-2H3
- InChI Key
- MPLLSYWBBPPERF-UHFFFAOYSA-N
- Formula
- C17H34O2
- SMILES
- CCCCCCCCCC(=O)OCCCCCCC
- Molecular Weight1
- 270.45
- CAS
- 60160-17-0
- Other Names
-
- Decanoic acid, heptyl ester
- Heptyl decanoate
- 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.
- 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 |
|---|---|---|---|
| ΔfG° | -141.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -639.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.59 | kJ/mol | Joback Calculated Property |
| log10WS | -5.80 | Crippen Calculated Property | |
| logPoct/wat | 5.641 | Crippen Calculated Property | |
| McVol | 257.830 | ml/mol | McGowan Calculated Property |
| Pc | 1271.87 | kPa | Joback Calculated Property |
| Inp | [1878.00; 1885.00] |
|
|
| Inp | 1885.00 | NIST | |
| Inp | 1878.00 | NIST | |
| I | [1864.00; 1864.00] |
|
|
| I | 1864.00 | NIST | |
| I | 1864.00 | NIST | |
| Tboil | 664.65 | K | Joback Calculated Property |
| Tc | 832.26 | K | Joback Calculated Property |
| Tfus | 353.51 | K | Joback Calculated Property |
| Vc | 1.012 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [732.28; 830.80] | J/mol×K | [664.65; 832.26] |
|
| Cp,gas | 732.28 | J/mol×K | 664.65 | Joback Calculated Property |
| Cp,gas | 750.62 | J/mol×K | 692.59 | Joback Calculated Property |
| Cp,gas | 768.17 | J/mol×K | 720.52 | Joback Calculated Property |
| Cp,gas | 784.95 | J/mol×K | 748.46 | Joback Calculated Property |
| Cp,gas | 800.97 | J/mol×K | 776.39 | Joback Calculated Property |
| Cp,gas | 816.25 | J/mol×K | 804.33 | Joback Calculated Property |
| Cp,gas | 830.80 | J/mol×K | 832.26 | Joback Calculated Property |
| η | [0.0001081; 0.0022120] | Pa×s | [353.51; 664.65] |
|
| η | 0.0022120 | Pa×s | 353.51 | Joback Calculated Property |
| η | 0.0009695 | Pa×s | 405.37 | Joback Calculated Property |
| η | 0.0005124 | Pa×s | 457.22 | Joback Calculated Property |
| η | 0.0003083 | Pa×s | 509.08 | Joback Calculated Property |
| η | 0.0002038 | Pa×s | 560.94 | Joback Calculated Property |
| η | 0.0001445 | Pa×s | 612.79 | Joback Calculated Property |
| η | 0.0001081 | Pa×s | 664.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to n-Capric acid n-heptyl ester.
Sources
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