- InChI
- InChI=1S/C19H26BrClO5/c1-24-17-14-15(20)8-9-16(17)26-19(23)11-10-18(22)25-13-7-5-3-2-4-6-12-21/h8-9,14H,2-7,10-13H2,1H3
- InChI Key
- ZYSCYMLLLPFMJI-UHFFFAOYSA-N
- Formula
- C19H26BrClO5
- SMILES
-
COc1cc(Br)ccc1OC(=O)CCC(=O)OCC
CCCCCCCl - Molecular Weight1
- 449.76
- 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° | -368.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -833.13 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.03 | kJ/mol | Joback Calculated Property |
| log10WS | -6.27 | Crippen Calculated Property | |
| logPoct/wat | 5.266 | Crippen Calculated Property | |
| McVol | 305.300 | ml/mol | McGowan Calculated Property |
| Pc | 1441.35 | kPa | Joback Calculated Property |
| Inp | [3116.00; 3116.00] |
|
|
| Inp | 3116.00 | NIST | |
| Inp | 3116.00 | NIST | |
| Tboil | 949.35 | K | Joback Calculated Property |
| Tc | 1167.71 | K | Joback Calculated Property |
| Tfus | 611.62 | K | Joback Calculated Property |
| Vc | 1.169 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [909.04; 964.27] | J/mol×K | [949.35; 1167.71] |
|
| Cp,gas | 909.04 | J/mol×K | 949.35 | Joback Calculated Property |
| Cp,gas | 921.35 | J/mol×K | 985.74 | Joback Calculated Property |
| Cp,gas | 932.40 | J/mol×K | 1022.14 | Joback Calculated Property |
| Cp,gas | 942.20 | J/mol×K | 1058.53 | Joback Calculated Property |
| Cp,gas | 950.77 | J/mol×K | 1094.93 | Joback Calculated Property |
| Cp,gas | 958.12 | J/mol×K | 1131.32 | Joback Calculated Property |
| Cp,gas | 964.27 | J/mol×K | 1167.71 | Joback Calculated Property |
| η | [0.0000317; 0.0002220] | Pa×s | [611.62; 949.35] |
|
| η | 0.0002220 | Pa×s | 611.62 | Joback Calculated Property |
| η | 0.0001400 | Pa×s | 667.91 | Joback Calculated Property |
| η | 0.0000949 | Pa×s | 724.20 | Joback Calculated Property |
| η | 0.0000680 | Pa×s | 780.48 | Joback Calculated Property |
| η | 0.0000510 | Pa×s | 836.77 | Joback Calculated Property |
| η | 0.0000396 | Pa×s | 893.06 | Joback Calculated Property |
| η | 0.0000317 | Pa×s | 949.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 8-chlorooctyl 4-bromo-2-methoxyphenyl ester.
Sources
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