- InChI
- InChI=1S/C30H50O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-33-28(31)30(4,5)29(32)35-27-23-20-19-22-26(27)34-25(2)3/h19-20,22-23,25H,6-18,21,24H2,1-5H3
- InChI Key
- VRMQUQNACGGLIQ-UHFFFAOYSA-N
- Formula
- C30H50O5
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)C(C)(C)C
(=O)Oc1ccccc1OC(C)C - Molecular Weight1
- 490.71
- 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° | -267.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1073.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.35 | kJ/mol | Joback Calculated Property |
| log10WS | -9.43 | Crippen Calculated Property | |
| logPoct/wat | 8.430 | Crippen Calculated Property | |
| McVol | 430.550 | ml/mol | McGowan Calculated Property |
| Pc | 738.42 | kPa | Joback Calculated Property |
| Inp | [3174.00; 3174.00] |
|
|
| Inp | 3174.00 | NIST | |
| Inp | 3174.00 | NIST | |
| Tboil | 1088.79 | K | Joback Calculated Property |
| Tc | 1344.16 | K | Joback Calculated Property |
| Tfus | 620.77 | K | Joback Calculated Property |
| Vc | 1.657 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1525.07; 1601.69] | J/mol×K | [1088.79; 1344.16] |
|
| Cp,gas | 1525.07 | J/mol×K | 1088.79 | Joback Calculated Property |
| Cp,gas | 1542.71 | J/mol×K | 1131.35 | Joback Calculated Property |
| Cp,gas | 1558.26 | J/mol×K | 1173.91 | Joback Calculated Property |
| Cp,gas | 1571.83 | J/mol×K | 1216.47 | Joback Calculated Property |
| Cp,gas | 1583.51 | J/mol×K | 1259.04 | Joback Calculated Property |
| Cp,gas | 1593.43 | J/mol×K | 1301.60 | Joback Calculated Property |
| Cp,gas | 1601.69 | J/mol×K | 1344.16 | Joback Calculated Property |
| η | [0.0000060; 0.0001138] | Pa×s | [620.77; 1088.79] |
|
| η | 0.0001138 | Pa×s | 620.77 | Joback Calculated Property |
| η | 0.0000530 | Pa×s | 698.77 | Joback Calculated Property |
| η | 0.0000287 | Pa×s | 776.78 | Joback Calculated Property |
| η | 0.0000174 | Pa×s | 854.78 | Joback Calculated Property |
| η | 0.0000115 | Pa×s | 932.78 | Joback Calculated Property |
| η | 0.0000081 | Pa×s | 1010.79 | Joback Calculated Property |
| η | 0.0000060 | Pa×s | 1088.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, hexadecyl 2-isopropoxyphenyl ester.
Sources
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