- InChI
- InChI=1S/C18H33ClO4/c1-18(2,3)15-23-17(21)12-10-11-16(20)22-14-9-7-5-4-6-8-13-19/h4-15H2,1-3H3
- InChI Key
- ZVBXNQJBENHTCA-UHFFFAOYSA-N
- Formula
- C18H33ClO4
- SMILES
-
CC(C)(C)COC(=O)CCCC(=O)OCCCCCC
CCCl - Molecular Weight1
- 348.90
- 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° | -376.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -928.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.06 | kJ/mol | Joback Calculated Property |
| log10WS | -4.99 | Crippen Calculated Property | |
| logPoct/wat | 4.869 | Crippen Calculated Property | |
| McVol | 291.600 | ml/mol | McGowan Calculated Property |
| Pc | 1212.36 | kPa | Joback Calculated Property |
| Inp | [2358.00; 2358.00] |
|
|
| Inp | 2358.00 | NIST | |
| Inp | 2358.00 | NIST | |
| Tboil | 798.02 | K | Joback Calculated Property |
| Tc | 986.05 | K | Joback Calculated Property |
| Tfus | 469.28 | K | Joback Calculated Property |
| Vc | 1.129 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [882.37; 967.69] | J/mol×K | [798.02; 986.05] |
|
| Cp,gas | 882.37 | J/mol×K | 798.02 | Joback Calculated Property |
| Cp,gas | 898.95 | J/mol×K | 829.36 | Joback Calculated Property |
| Cp,gas | 914.54 | J/mol×K | 860.70 | Joback Calculated Property |
| Cp,gas | 929.19 | J/mol×K | 892.04 | Joback Calculated Property |
| Cp,gas | 942.91 | J/mol×K | 923.38 | Joback Calculated Property |
| Cp,gas | 955.73 | J/mol×K | 954.71 | Joback Calculated Property |
| Cp,gas | 967.69 | J/mol×K | 986.05 | Joback Calculated Property |
| η | [0.0000492; 0.0007842] | Pa×s | [469.28; 798.02] |
|
| η | 0.0007842 | Pa×s | 469.28 | Joback Calculated Property |
| η | 0.0003884 | Pa×s | 524.07 | Joback Calculated Property |
| η | 0.0002198 | Pa×s | 578.86 | Joback Calculated Property |
| η | 0.0001372 | Pa×s | 633.65 | Joback Calculated Property |
| η | 0.0000923 | Pa×s | 688.44 | Joback Calculated Property |
| η | 0.0000659 | Pa×s | 743.23 | Joback Calculated Property |
| η | 0.0000492 | Pa×s | 798.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 8-chlorooctyl neopentyl ester.
Sources
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