- InChI
- InChI=1S/C24H37BrO4/c1-4-7-8-9-10-11-12-13-17-28-22(26)24(5-2,6-3)23(27)29-19-20-15-14-16-21(25)18-20/h14-16,18H,4-13,17,19H2,1-3H3
- InChI Key
- AXRKPBAYFQYRAT-UHFFFAOYSA-N
- Formula
- C24H37BrO4
- SMILES
-
CCCCCCCCCCOC(=O)C(CC)(CC)C(=O)
OCc1cccc(Br)c1 - Molecular Weight1
- 469.45
- 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° | -196.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -785.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.41 | kJ/mol | Joback Calculated Property |
| log10WS | -8.11 | Crippen Calculated Property | |
| logPoct/wat | 6.983 | Crippen Calculated Property | |
| McVol | 357.640 | ml/mol | McGowan Calculated Property |
| Pc | 1092.10 | kPa | Joback Calculated Property |
| Inp | [2839.00; 2839.00] |
|
|
| Inp | 2839.00 | NIST | |
| Inp | 2839.00 | NIST | |
| Tboil | 995.69 | K | Joback Calculated Property |
| Tc | 1219.75 | K | Joback Calculated Property |
| Tfus | 605.72 | K | Joback Calculated Property |
| Vc | 1.371 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1159.67; 1235.47] | J/mol×K | [995.69; 1219.75] |
|
| Cp,gas | 1159.67 | J/mol×K | 995.69 | Joback Calculated Property |
| Cp,gas | 1175.14 | J/mol×K | 1033.03 | Joback Calculated Property |
| Cp,gas | 1189.37 | J/mol×K | 1070.38 | Joback Calculated Property |
| Cp,gas | 1202.44 | J/mol×K | 1107.72 | Joback Calculated Property |
| Cp,gas | 1214.42 | J/mol×K | 1145.07 | Joback Calculated Property |
| Cp,gas | 1225.41 | J/mol×K | 1182.41 | Joback Calculated Property |
| Cp,gas | 1235.47 | J/mol×K | 1219.75 | Joback Calculated Property |
| η | [0.0000175; 0.0002065] | Pa×s | [605.72; 995.69] |
|
| η | 0.0002065 | Pa×s | 605.72 | Joback Calculated Property |
| η | 0.0001122 | Pa×s | 670.72 | Joback Calculated Property |
| η | 0.0000679 | Pa×s | 735.71 | Joback Calculated Property |
| η | 0.0000446 | Pa×s | 800.70 | Joback Calculated Property |
| η | 0.0000312 | Pa×s | 865.70 | Joback Calculated Property |
| η | 0.0000229 | Pa×s | 930.69 | Joback Calculated Property |
| η | 0.0000175 | Pa×s | 995.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 3-bromobenzyl decyl ester.
Sources
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