- InChI
- InChI=1S/C19H27BrO5/c1-4-6-7-14(5-2)13-24-18(21)10-11-19(22)25-16-9-8-15(20)12-17(16)23-3/h8-9,12,14H,4-7,10-11,13H2,1-3H3
- InChI Key
- QATCBXHWCVEQAA-UHFFFAOYSA-N
- Formula
- C19H27BrO5
- SMILES
-
CCCCC(CC)COC(=O)CCC(=O)Oc1ccc(
Br)cc1OC - Molecular Weight1
- 415.32
- 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° | -358.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -822.67 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.26 | kJ/mol | Joback Calculated Property |
| log10WS | -5.87 | Crippen Calculated Property | |
| logPoct/wat | 4.903 | Crippen Calculated Property | |
| McVol | 293.060 | ml/mol | McGowan Calculated Property |
| Pc | 1491.89 | kPa | Joback Calculated Property |
| Inp | [2694.00; 2694.00] |
|
|
| Inp | 2694.00 | NIST | |
| Inp | 2694.00 | NIST | |
| Tboil | 911.48 | K | Joback Calculated Property |
| Tc | 1125.70 | K | Joback Calculated Property |
| Tfus | 566.70 | K | Joback Calculated Property |
| Vc | 1.113 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [886.61; 949.77] | J/mol×K | [911.48; 1125.70] |
|
| Cp,gas | 886.61 | J/mol×K | 911.48 | Joback Calculated Property |
| Cp,gas | 900.24 | J/mol×K | 947.18 | Joback Calculated Property |
| Cp,gas | 912.61 | J/mol×K | 982.89 | Joback Calculated Property |
| Cp,gas | 923.74 | J/mol×K | 1018.59 | Joback Calculated Property |
| Cp,gas | 933.63 | J/mol×K | 1054.29 | Joback Calculated Property |
| Cp,gas | 942.30 | J/mol×K | 1090.00 | Joback Calculated Property |
| Cp,gas | 949.77 | J/mol×K | 1125.70 | Joback Calculated Property |
| η | [0.0000344; 0.0002932] | Pa×s | [566.70; 911.48] |
|
| η | 0.0002932 | Pa×s | 566.70 | Joback Calculated Property |
| η | 0.0001740 | Pa×s | 624.16 | Joback Calculated Property |
| η | 0.0001128 | Pa×s | 681.63 | Joback Calculated Property |
| η | 0.0000782 | Pa×s | 739.09 | Joback Calculated Property |
| η | 0.0000571 | Pa×s | 796.55 | Joback Calculated Property |
| η | 0.0000436 | Pa×s | 854.02 | Joback Calculated Property |
| η | 0.0000344 | Pa×s | 911.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-ethylhexyl 4-bromo-2-methoxyphenyl ester.
Sources
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