- InChI
- InChI=1S/C23H46O2/c1-7-20(5)16-14-12-10-9-11-13-15-17-21(6)18-23(24)25-22(8-2)19(3)4/h19-22H,7-18H2,1-6H3
- InChI Key
- AJQJSPMMDNUUDH-UHFFFAOYSA-N
- Formula
- C23H46O2
- SMILES
-
CCC(C)CCCCCCCCCC(C)CC(=O)OC(CC
)C(C)C - Molecular Weight1
- 354.61
- 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° | -100.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -783.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.40 | kJ/mol | Joback Calculated Property |
| log10WS | -7.70 | Crippen Calculated Property | |
| logPoct/wat | 7.547 | Crippen Calculated Property | |
| McVol | 342.370 | ml/mol | McGowan Calculated Property |
| Pc | 892.13 | kPa | Joback Calculated Property |
| Inp | 2279.00 | NIST | |
| Tboil | 800.17 | K | Joback Calculated Property |
| Tc | 982.73 | K | Joback Calculated Property |
| Tfus | 361.13 | K | Joback Calculated Property |
| Vc | 1.323 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1095.26; 1206.97] | J/mol×K | [800.17; 982.73] | 
|
| Cp,gas | 1095.26 | J/mol×K | 800.17 | Joback Calculated Property |
| Cp,gas | 1116.64 | J/mol×K | 830.60 | Joback Calculated Property |
| Cp,gas | 1136.87 | J/mol×K | 861.02 | Joback Calculated Property |
| Cp,gas | 1155.98 | J/mol×K | 891.45 | Joback Calculated Property |
| Cp,gas | 1174.02 | J/mol×K | 921.87 | Joback Calculated Property |
| Cp,gas | 1191.00 | J/mol×K | 952.30 | Joback Calculated Property |
| Cp,gas | 1206.97 | J/mol×K | 982.73 | Joback Calculated Property |
| η | [0.0000344; 0.0032612] | Pa×s | [361.13; 800.17] |
|
| η | 0.0032612 | Pa×s | 361.13 | Joback Calculated Property |
| η | 0.0008061 | Pa×s | 434.30 | Joback Calculated Property |
| η | 0.0002982 | Pa×s | 507.48 | Joback Calculated Property |
| η | 0.0001417 | Pa×s | 580.65 | Joback Calculated Property |
| η | 0.0000795 | Pa×s | 653.82 | Joback Calculated Property |
| η | 0.0000502 | Pa×s | 727.00 | Joback Calculated Property |
| η | 0.0000344 | Pa×s | 800.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-ethyl-2-methylpropyl 3,13-dimethylpentadecanoate.
Sources
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