- InChI
- InChI=1S/C24H37ClO4/c1-2-3-4-5-6-7-8-9-13-20-28-23(26)14-11-10-12-15-24(27)29-22-18-16-21(25)17-19-22/h16-19H,2-15,20H2,1H3
- InChI Key
- BXFYFHYNGQGJQG-UHFFFAOYSA-N
- Formula
- C24H37ClO4
- SMILES
-
CCCCCCCCCCCOC(=O)CCCCCC(=O)Oc1
ccc(Cl)cc1 - Molecular Weight1
- 425.00
- 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).
- 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 |
|---|---|---|---|
| ω | 1.1627 | Relay (1.0) Calculated Property | |
| ΔfG° | -225.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -952.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 61.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 121.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.55 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.10 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.270 | Crippen Calculated Property | |
| McVol | 352.380 | ml/mol | McGowan Calculated Property |
| Pc | 1007.17 | kPa | Joback Calculated Property |
| Inp | [3097.00; 3097.00] |
|
|
| Inp | 3097.00 | NIST | |
| Inp | 3097.00 | NIST | |
| Tboil | 677.09 | K | Relay (1.0) Calculated Property |
| Tc | 877.92 | K | Relay (1.0) Calculated Property |
| Tfus | 319.32 | K | Relay (1.0) Calculated Property |
| Vc | 1.323 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1146.11; 1221.10] | J/mol×K | [970.19; 1187.80] |
|
| Cp,gas | 1146.11 | J/mol×K | 970.19 | Joback Calculated Property |
| Cp,gas | 1161.98 | J/mol×K | 1006.46 | Joback Calculated Property |
| Cp,gas | 1176.44 | J/mol×K | 1042.73 | Joback Calculated Property |
| Cp,gas | 1189.54 | J/mol×K | 1079.00 | Joback Calculated Property |
| Cp,gas | 1201.32 | J/mol×K | 1115.26 | Joback Calculated Property |
| Cp,gas | 1211.83 | J/mol×K | 1151.53 | Joback Calculated Property |
| Cp,gas | 1221.10 | J/mol×K | 1187.80 | Joback Calculated Property |
| η | [0.0000260; 0.0003068] | Pa×s | [573.42; 970.19] |
|
| η | 0.0003068 | Pa×s | 573.42 | Joback Calculated Property |
| η | 0.0001644 | Pa×s | 639.55 | Joback Calculated Property |
| η | 0.0000990 | Pa×s | 705.68 | Joback Calculated Property |
| η | 0.0000650 | Pa×s | 771.81 | Joback Calculated Property |
| η | 0.0000457 | Pa×s | 837.93 | Joback Calculated Property |
| η | 0.0000338 | Pa×s | 904.06 | Joback Calculated Property |
| η | 0.0000260 | Pa×s | 970.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pimelic acid, 4-chlorophenyl undecyl ester.
Sources
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