- InChI
- InChI=1S/C30H49ClO4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25-34-28(32)30(5-2,6-3)29(33)35-27-24-21-20-23-26(27)31/h20-21,23-24H,4-19,22,25H2,1-3H3
- InChI Key
- FCICHOIPTPCMRR-UHFFFAOYSA-N
- Formula
- C30H49ClO4
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)C(CC)(C
C)C(=O)Oc1ccccc1Cl - Molecular Weight1
- 509.16
- 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 | 1.2472 | Relay (1.0) Calculated Property | |
| ΔfG° | -172.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1048.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 69.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 140.80 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.48 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.466 | Crippen Calculated Property | |
| McVol | 436.920 | ml/mol | McGowan Calculated Property |
| Pc | 727.31 | kPa | Joback Calculated Property |
| Inp | 3388.00 | NIST | |
| Tboil | 686.85 | K | Relay (1.0) Calculated Property |
| Tc | 922.54 | K | Relay (1.0) Calculated Property |
| Tfus | 325.51 | K | Relay (1.0) Calculated Property |
| Vc | 1.607 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1521.79; 1606.32] | J/mol×K | [1104.24; 1364.90] | 
|
| Cp,gas | 1521.79 | J/mol×K | 1104.24 | Joback Calculated Property |
| Cp,gas | 1539.86 | J/mol×K | 1147.68 | Joback Calculated Property |
| Cp,gas | 1556.13 | J/mol×K | 1191.13 | Joback Calculated Property |
| Cp,gas | 1570.77 | J/mol×K | 1234.57 | Joback Calculated Property |
| Cp,gas | 1583.92 | J/mol×K | 1278.01 | Joback Calculated Property |
| Cp,gas | 1595.72 | J/mol×K | 1321.46 | Joback Calculated Property |
| Cp,gas | 1606.32 | J/mol×K | 1364.90 | Joback Calculated Property |
| η | [0.0000074; 0.0001184] | Pa×s | [643.46; 1104.24] |
|
| η | 0.0001184 | Pa×s | 643.46 | Joback Calculated Property |
| η | 0.0000584 | Pa×s | 720.26 | Joback Calculated Property |
| η | 0.0000330 | Pa×s | 797.05 | Joback Calculated Property |
| η | 0.0000206 | Pa×s | 873.85 | Joback Calculated Property |
| η | 0.0000139 | Pa×s | 950.65 | Joback Calculated Property |
| η | 0.0000099 | Pa×s | 1027.44 | Joback Calculated Property |
| η | 0.0000074 | Pa×s | 1104.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2-chlorophenyl heptadecyl ester.
Sources
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