- InChI
- InChI=1S/C20H29BrO5/c1-4-6-8-15(5-2)14-25-19(22)9-7-10-20(23)26-17-12-11-16(21)13-18(17)24-3/h11-13,15H,4-10,14H2,1-3H3
- InChI Key
- CYHKZMSECOXDBB-UHFFFAOYSA-N
- Formula
- C20H29BrO5
- SMILES
-
CCCCC(CC)COC(=O)CCCC(=O)Oc1ccc
(Br)cc1OC - Molecular Weight1
- 429.35
- 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° | -350.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -843.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.48 | kJ/mol | Joback Calculated Property |
| log10WS | -6.29 | Crippen Calculated Property | |
| logPoct/wat | 5.293 | Crippen Calculated Property | |
| McVol | 307.150 | ml/mol | McGowan Calculated Property |
| Pc | 1387.11 | kPa | Joback Calculated Property |
| Inp | [2766.00; 2766.00] |
|
|
| Inp | 2766.00 | NIST | |
| Inp | 2766.00 | NIST | |
| Tboil | 934.36 | K | Joback Calculated Property |
| Tc | 1149.94 | K | Joback Calculated Property |
| Tfus | 577.97 | K | Joback Calculated Property |
| Vc | 1.169 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [945.56; 1008.64] | J/mol×K | [934.36; 1149.94] |
|
| Cp,gas | 945.56 | J/mol×K | 934.36 | Joback Calculated Property |
| Cp,gas | 959.31 | J/mol×K | 970.29 | Joback Calculated Property |
| Cp,gas | 971.75 | J/mol×K | 1006.22 | Joback Calculated Property |
| Cp,gas | 982.89 | J/mol×K | 1042.15 | Joback Calculated Property |
| Cp,gas | 992.74 | J/mol×K | 1078.08 | Joback Calculated Property |
| Cp,gas | 1001.32 | J/mol×K | 1114.01 | Joback Calculated Property |
| Cp,gas | 1008.64 | J/mol×K | 1149.94 | Joback Calculated Property |
| η | [0.0000295; 0.0002618] | Pa×s | [577.97; 934.36] |
|
| η | 0.0002618 | Pa×s | 577.97 | Joback Calculated Property |
| η | 0.0001536 | Pa×s | 637.37 | Joback Calculated Property |
| η | 0.0000987 | Pa×s | 696.77 | Joback Calculated Property |
| η | 0.0000680 | Pa×s | 756.16 | Joback Calculated Property |
| η | 0.0000495 | Pa×s | 815.56 | Joback Calculated Property |
| η | 0.0000376 | Pa×s | 874.96 | Joback Calculated Property |
| η | 0.0000295 | Pa×s | 934.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2-ethylhexyl 4-bromo-2-methoxyphenyl ester.
Sources
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