- InChI
- InChI=1S/C19H18Br2O6/c1-24-16-10-12(20)6-8-14(16)26-18(22)4-3-5-19(23)27-15-9-7-13(21)11-17(15)25-2/h6-11H,3-5H2,1-2H3
- InChI Key
- YHCNGQMRBCAIFD-UHFFFAOYSA-N
- Formula
- C19H18Br2O6
- SMILES
-
COc1cc(Br)ccc1OC(=O)CCCC(=O)Oc
1ccc(Br)cc1OC - Molecular Weight1
- 502.15
- 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° | -353.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -709.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.09 | kJ/mol | Joback Calculated Property |
| log10WS | -6.73 | Crippen Calculated Property | |
| logPoct/wat | 4.910 | Crippen Calculated Property | |
| McVol | 292.670 | ml/mol | McGowan Calculated Property |
| Pc | 1985.89 | kPa | Joback Calculated Property |
| Inp | [3319.00; 3319.00] |
|
|
| Inp | 3319.00 | NIST | |
| Inp | 3319.00 | NIST | |
| Tboil | 1037.14 | K | Joback Calculated Property |
| Tc | 1283.28 | K | Joback Calculated Property |
| Tfus | 715.19 | K | Joback Calculated Property |
| Vc | 1.091 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [828.84; 851.16] | J/mol×K | [1037.14; 1283.28] |
|
| Cp,gas | 828.84 | J/mol×K | 1037.14 | Joback Calculated Property |
| Cp,gas | 836.50 | J/mol×K | 1078.16 | Joback Calculated Property |
| Cp,gas | 842.56 | J/mol×K | 1119.19 | Joback Calculated Property |
| Cp,gas | 847.03 | J/mol×K | 1160.21 | Joback Calculated Property |
| Cp,gas | 849.90 | J/mol×K | 1201.23 | Joback Calculated Property |
| Cp,gas | 851.16 | J/mol×K | 1242.26 | Joback Calculated Property |
| Cp,gas | 850.83 | J/mol×K | 1283.28 | Joback Calculated Property |
| η | [0.0000227; 0.0001043] | Pa×s | [715.19; 1037.14] |
|
| η | 0.0001043 | Pa×s | 715.19 | Joback Calculated Property |
| η | 0.0000741 | Pa×s | 768.85 | Joback Calculated Property |
| η | 0.0000550 | Pa×s | 822.51 | Joback Calculated Property |
| η | 0.0000423 | Pa×s | 876.17 | Joback Calculated Property |
| η | 0.0000336 | Pa×s | 929.82 | Joback Calculated Property |
| η | 0.0000273 | Pa×s | 983.48 | Joback Calculated Property |
| η | 0.0000227 | Pa×s | 1037.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, di(4-bromo-2-methoxyphenyl) ester.
Sources
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