- InChI
- InChI=1S/C16H29BrO4/c1-14(2)13-21-16(19)10-9-15(18)20-12-8-6-4-3-5-7-11-17/h14H,3-13H2,1-2H3
- InChI Key
- ZUIFKCRYLRMLPM-UHFFFAOYSA-N
- Formula
- C16H29BrO4
- SMILES
- CC(C)COC(=O)CCC(=O)OCCCCCCCCBr
- Molecular Weight1
- 365.30
- 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° | -372.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -842.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.57 | kJ/mol | Joback Calculated Property |
| log10WS | -4.44 | Crippen Calculated Property | |
| logPoct/wat | 4.245 | Crippen Calculated Property | |
| McVol | 268.680 | ml/mol | McGowan Calculated Property |
| Pc | 1496.51 | kPa | Joback Calculated Property |
| Inp | [2306.00; 2306.00] |
|
|
| Inp | 2306.00 | NIST | |
| Inp | 2306.00 | NIST | |
| Tboil | 783.78 | K | Joback Calculated Property |
| Tc | 973.23 | K | Joback Calculated Property |
| Tfus | 459.20 | K | Joback Calculated Property |
| Vc | 1.036 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [780.96; 860.65] | J/mol×K | [783.78; 973.23] |
|
| Cp,gas | 780.96 | J/mol×K | 783.78 | Joback Calculated Property |
| Cp,gas | 796.45 | J/mol×K | 815.36 | Joback Calculated Property |
| Cp,gas | 811.03 | J/mol×K | 846.93 | Joback Calculated Property |
| Cp,gas | 824.73 | J/mol×K | 878.51 | Joback Calculated Property |
| Cp,gas | 837.55 | J/mol×K | 910.08 | Joback Calculated Property |
| Cp,gas | 849.52 | J/mol×K | 941.66 | Joback Calculated Property |
| Cp,gas | 860.65 | J/mol×K | 973.23 | Joback Calculated Property |
| η | [0.0000690; 0.0009230] | Pa×s | [459.20; 783.78] |
|
| η | 0.0009230 | Pa×s | 459.20 | Joback Calculated Property |
| η | 0.0004770 | Pa×s | 513.30 | Joback Calculated Property |
| η | 0.0002796 | Pa×s | 567.39 | Joback Calculated Property |
| η | 0.0001798 | Pa×s | 621.49 | Joback Calculated Property |
| η | 0.0001242 | Pa×s | 675.59 | Joback Calculated Property |
| η | 0.0000906 | Pa×s | 729.68 | Joback Calculated Property |
| η | 0.0000690 | Pa×s | 783.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 8-bromooctyl isobutyl ester.
Sources
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