- InChI
- InChI=1S/C15H19BrO5/c1-3-8-20-14(17)6-7-15(18)21-10-11-9-12(16)4-5-13(11)19-2/h4-5,9H,3,6-8,10H2,1-2H3
- InChI Key
- UGHHRHZFBRUFSA-UHFFFAOYSA-N
- Formula
- C15H19BrO5
- SMILES
-
CCCOC(=O)CCC(=O)OCc1cc(Br)ccc1
OC - Molecular Weight1
- 359.21
- 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° | -389.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -734.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.74 | kJ/mol | Joback Calculated Property |
| log10WS | -4.29 | Crippen Calculated Property | |
| logPoct/wat | 3.234 | Crippen Calculated Property | |
| McVol | 236.700 | ml/mol | McGowan Calculated Property |
| Pc | 2041.91 | kPa | Joback Calculated Property |
| Inp | [2357.00; 2357.00] |
|
|
| Inp | 2357.00 | NIST | |
| Inp | 2357.00 | NIST | |
| Tboil | 820.40 | K | Joback Calculated Property |
| Tc | 1033.88 | K | Joback Calculated Property |
| Tfus | 536.62 | K | Joback Calculated Property |
| Vc | 0.895 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [657.39; 718.41] | J/mol×K | [820.40; 1033.88] |
|
| Cp,gas | 657.39 | J/mol×K | 820.40 | Joback Calculated Property |
| Cp,gas | 670.12 | J/mol×K | 855.98 | Joback Calculated Property |
| Cp,gas | 681.83 | J/mol×K | 891.56 | Joback Calculated Property |
| Cp,gas | 692.52 | J/mol×K | 927.14 | Joback Calculated Property |
| Cp,gas | 702.18 | J/mol×K | 962.72 | Joback Calculated Property |
| Cp,gas | 710.81 | J/mol×K | 998.30 | Joback Calculated Property |
| Cp,gas | 718.41 | J/mol×K | 1033.88 | Joback Calculated Property |
| η | [0.0000672; 0.0004079] | Pa×s | [536.62; 820.40] |
|
| η | 0.0004079 | Pa×s | 536.62 | Joback Calculated Property |
| η | 0.0002674 | Pa×s | 583.92 | Joback Calculated Property |
| η | 0.0001868 | Pa×s | 631.21 | Joback Calculated Property |
| η | 0.0001371 | Pa×s | 678.51 | Joback Calculated Property |
| η | 0.0001048 | Pa×s | 725.81 | Joback Calculated Property |
| η | 0.0000828 | Pa×s | 773.10 | Joback Calculated Property |
| η | 0.0000672 | Pa×s | 820.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 5-bromo-2-methoxybenzyl propyl ester.
Sources
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