- InChI
- InChI=1S/C24H37BrO5/c1-2-3-4-11-18-29-23(26)12-9-7-5-6-8-10-13-24(27)30-20-19-28-22-16-14-21(25)15-17-22/h14-17H,2-13,18-20H2,1H3
- InChI Key
- ISWGODUQEDMNCX-UHFFFAOYSA-N
- Formula
- C24H37BrO5
- SMILES
-
CCCCCCOC(=O)CCCCCCCCC(=O)OCCOc
1ccc(Br)cc1 - Molecular Weight1
- 485.45
- 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° | -304.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -909.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 63.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.11 | kJ/mol | Joback Calculated Property |
| log10WS | -7.60 | Crippen Calculated Property | |
| logPoct/wat | 6.615 | Crippen Calculated Property | |
| McVol | 363.510 | ml/mol | McGowan Calculated Property |
| Pc | 1066.57 | kPa | Joback Calculated Property |
| Inp | [3293.00; 3293.00] |
|
|
| Inp | 3293.00 | NIST | |
| Inp | 3293.00 | NIST | |
| Tboil | 1021.34 | K | Joback Calculated Property |
| Tc | 1250.81 | K | Joback Calculated Property |
| Tfus | 625.53 | K | Joback Calculated Property |
| Vc | 1.399 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1187.35; 1251.21] | J/mol×K | [1021.34; 1250.81] |
|
| Cp,gas | 1187.35 | J/mol×K | 1021.34 | Joback Calculated Property |
| Cp,gas | 1201.83 | J/mol×K | 1059.58 | Joback Calculated Property |
| Cp,gas | 1214.72 | J/mol×K | 1097.83 | Joback Calculated Property |
| Cp,gas | 1226.06 | J/mol×K | 1136.07 | Joback Calculated Property |
| Cp,gas | 1235.90 | J/mol×K | 1174.32 | Joback Calculated Property |
| Cp,gas | 1244.27 | J/mol×K | 1212.56 | Joback Calculated Property |
| Cp,gas | 1251.21 | J/mol×K | 1250.81 | Joback Calculated Property |
| η | [0.0000170; 0.0001678] | Pa×s | [625.53; 1021.34] |
|
| η | 0.0001678 | Pa×s | 625.53 | Joback Calculated Property |
| η | 0.0000955 | Pa×s | 691.50 | Joback Calculated Property |
| η | 0.0000600 | Pa×s | 757.47 | Joback Calculated Property |
| η | 0.0000406 | Pa×s | 823.43 | Joback Calculated Property |
| η | 0.0000291 | Pa×s | 889.40 | Joback Calculated Property |
| η | 0.0000218 | Pa×s | 955.37 | Joback Calculated Property |
| η | 0.0000170 | Pa×s | 1021.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 2-(4-bromophenoxy)ethyl hexyl ester.
Sources
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