- InChI
- InChI=1S/C24H48O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-22(3)26-23(25)19-21(2)20-24(4,5)6/h21-22H,7-20H2,1-6H3
- InChI Key
- QWXUBDGYOJQHIO-UHFFFAOYSA-N
- Formula
- C24H48O2
- SMILES
-
CCCCCCCCCCCCCC(C)OC(=O)CC(C)CC
(C)(C)C - Molecular Weight1
- 368.64
- 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° | -84.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -802.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.10 | kJ/mol | Joback Calculated Property |
| log10WS | -8.36 | Crippen Calculated Property | |
| logPoct/wat | 8.082 | Crippen Calculated Property | |
| McVol | 356.460 | ml/mol | McGowan Calculated Property |
| Pc | 844.56 | kPa | Joback Calculated Property |
| Inp | [2336.00; 2336.00] |
|
|
| Inp | 2336.00 | NIST | |
| Inp | 2336.00 | NIST | |
| Tboil | 820.70 | K | Joback Calculated Property |
| Tc | 1006.64 | K | Joback Calculated Property |
| Tfus | 404.82 | K | Joback Calculated Property |
| Vc | 1.381 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1158.15; 1270.97] | J/mol×K | [820.70; 1006.64] |
|
| Cp,gas | 1158.15 | J/mol×K | 820.70 | Joback Calculated Property |
| Cp,gas | 1179.72 | J/mol×K | 851.69 | Joback Calculated Property |
| Cp,gas | 1200.12 | J/mol×K | 882.68 | Joback Calculated Property |
| Cp,gas | 1219.39 | J/mol×K | 913.67 | Joback Calculated Property |
| Cp,gas | 1237.59 | J/mol×K | 944.66 | Joback Calculated Property |
| Cp,gas | 1254.76 | J/mol×K | 975.65 | Joback Calculated Property |
| Cp,gas | 1270.97 | J/mol×K | 1006.64 | Joback Calculated Property |
| η | [0.0000281; 0.0016496] | Pa×s | [404.82; 820.70] |
|
| η | 0.0016496 | Pa×s | 404.82 | Joback Calculated Property |
| η | 0.0005093 | Pa×s | 474.13 | Joback Calculated Property |
| η | 0.0002122 | Pa×s | 543.45 | Joback Calculated Property |
| η | 0.0001078 | Pa×s | 612.76 | Joback Calculated Property |
| η | 0.0000628 | Pa×s | 682.07 | Joback Calculated Property |
| η | 0.0000404 | Pa×s | 751.39 | Joback Calculated Property |
| η | 0.0000281 | Pa×s | 820.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexanoic acid, 3,5,5-trimethyl-, pentadec-2-yl ester.
Sources
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