- InChI
- InChI=1S/C27H51ClO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-31-26(29)21-18-19-22-27(30)32-24-25(2)28/h25H,3-24H2,1-2H3
- InChI Key
- NFQPHOFHQFHPTI-UHFFFAOYSA-N
- Formula
- C27H51ClO4
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)CCCCC(
=O)OCC(C)Cl - Molecular Weight1
- 475.14
- 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° | -305.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1111.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 71.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.01 | kJ/mol | Joback Calculated Property |
| log10WS | -9.11 | Crippen Calculated Property | |
| logPoct/wat | 8.522 | Crippen Calculated Property | |
| McVol | 418.410 | ml/mol | McGowan Calculated Property |
| Pc | 712.25 | kPa | Joback Calculated Property |
| Inp | [3240.00; 3240.00] |
|
|
| Inp | 3240.00 | NIST | |
| Inp | 3240.00 | NIST | |
| Tboil | 1006.73 | K | Joback Calculated Property |
| Tc | 1247.18 | K | Joback Calculated Property |
| Tfus | 553.29 | K | Joback Calculated Property |
| Vc | 1.639 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1439.83; 1536.95] | J/mol×K | [1006.73; 1247.18] |
|
| Cp,gas | 1439.83 | J/mol×K | 1006.73 | Joback Calculated Property |
| Cp,gas | 1460.66 | J/mol×K | 1046.81 | Joback Calculated Property |
| Cp,gas | 1479.54 | J/mol×K | 1086.88 | Joback Calculated Property |
| Cp,gas | 1496.54 | J/mol×K | 1126.96 | Joback Calculated Property |
| Cp,gas | 1511.72 | J/mol×K | 1167.03 | Joback Calculated Property |
| Cp,gas | 1525.16 | J/mol×K | 1207.11 | Joback Calculated Property |
| Cp,gas | 1536.95 | J/mol×K | 1247.18 | Joback Calculated Property |
| η | [0.0000139; 0.0003072] | Pa×s | [553.29; 1006.73] |
|
| η | 0.0003072 | Pa×s | 553.29 | Joback Calculated Property |
| η | 0.0001346 | Pa×s | 628.86 | Joback Calculated Property |
| η | 0.0000704 | Pa×s | 704.44 | Joback Calculated Property |
| η | 0.0000418 | Pa×s | 780.01 | Joback Calculated Property |
| η | 0.0000272 | Pa×s | 855.58 | Joback Calculated Property |
| η | 0.0000189 | Pa×s | 931.16 | Joback Calculated Property |
| η | 0.0000139 | Pa×s | 1006.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, 2-chloropropyl octadecyl ester.
Sources
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