- InChI
- InChI=1S/C9H15BrO4/c1-3-13-8(11)6-5-7(10)9(12)14-4-2/h7H,3-6H2,1-2H3
- InChI Key
- OXJSWZSWGJACGU-UHFFFAOYSA-N
- Formula
- C9H15BrO4
- SMILES
- CCOC(=O)CCC(Br)C(=O)OCC
- Molecular Weight1
- 267.12
- CAS
- 7209-00-9
- 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).
- 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° | -431.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -697.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.99 | kJ/mol | Joback Calculated Property |
| log10WS | -1.86 | Crippen Calculated Property | |
| logPoct/wat | 1.656 | Crippen Calculated Property | |
| McVol | 170.050 | ml/mol | McGowan Calculated Property |
| Pc | 2732.56 | kPa | Joback Calculated Property |
| Tboil | 623.62 | K | Joback Calculated Property |
| Tc | 821.10 | K | Joback Calculated Property |
| Tfus | 380.31 | K | Joback Calculated Property |
| Vc | 0.643 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [407.44; 470.13] | J/mol×K | [623.62; 821.10] | 
|
| Cp,gas | 407.44 | J/mol×K | 623.62 | Joback Calculated Property |
| Cp,gas | 419.39 | J/mol×K | 656.53 | Joback Calculated Property |
| Cp,gas | 430.73 | J/mol×K | 689.45 | Joback Calculated Property |
| Cp,gas | 441.48 | J/mol×K | 722.36 | Joback Calculated Property |
| Cp,gas | 451.63 | J/mol×K | 755.27 | Joback Calculated Property |
| Cp,gas | 461.18 | J/mol×K | 788.19 | Joback Calculated Property |
| Cp,gas | 470.13 | J/mol×K | 821.10 | Joback Calculated Property |
| η | [0.0001811; 0.0017612] | Pa×s | [380.31; 623.62] |
|
| η | 0.0017612 | Pa×s | 380.31 | Joback Calculated Property |
| η | 0.0010043 | Pa×s | 420.86 | Joback Calculated Property |
| η | 0.0006321 | Pa×s | 461.41 | Joback Calculated Property |
| η | 0.0004288 | Pa×s | 501.97 | Joback Calculated Property |
| η | 0.0003082 | Pa×s | 542.52 | Joback Calculated Property |
| η | 0.0002320 | Pa×s | 583.07 | Joback Calculated Property |
| η | 0.0001811 | Pa×s | 623.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentanedioic acid, 2-bromo-, diethyl ester.
Sources
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