- InChI
- InChI=1S/C10H19BrO3/c1-9(5-7-13-2)8-14-10(12)4-3-6-11/h9H,3-8H2,1-2H3
- InChI Key
- OYVOWOWYHJTHDD-UHFFFAOYSA-N
- Formula
- C10H19BrO3
- SMILES
- COCCC(C)COC(=O)CCCBr
- Molecular Weight1
- 267.16
- 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° | -293.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -605.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.47 | kJ/mol | Joback Calculated Property |
| log10WS | -2.15 | Crippen Calculated Property | |
| logPoct/wat | 2.377 | Crippen Calculated Property | |
| McVol | 182.570 | ml/mol | McGowan Calculated Property |
| Pc | 2329.27 | kPa | Joback Calculated Property |
| Inp | [1619.00; 1619.00] |
|
|
| Inp | 1619.00 | NIST | |
| Inp | 1619.00 | NIST | |
| Tboil | 592.63 | K | Joback Calculated Property |
| Tc | 780.39 | K | Joback Calculated Property |
| Tfus | 341.65 | K | Joback Calculated Property |
| Vc | 0.694 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [438.95; 512.12] | J/mol×K | [592.63; 780.39] |
|
| Cp,gas | 438.95 | J/mol×K | 592.63 | Joback Calculated Property |
| Cp,gas | 452.65 | J/mol×K | 623.92 | Joback Calculated Property |
| Cp,gas | 465.75 | J/mol×K | 655.22 | Joback Calculated Property |
| Cp,gas | 478.24 | J/mol×K | 686.51 | Joback Calculated Property |
| Cp,gas | 490.13 | J/mol×K | 717.81 | Joback Calculated Property |
| Cp,gas | 501.43 | J/mol×K | 749.10 | Joback Calculated Property |
| Cp,gas | 512.12 | J/mol×K | 780.39 | Joback Calculated Property |
| η | [0.0001609; 0.0020810] | Pa×s | [341.65; 592.63] |
|
| η | 0.0020810 | Pa×s | 341.65 | Joback Calculated Property |
| η | 0.0010763 | Pa×s | 383.48 | Joback Calculated Property |
| η | 0.0006338 | Pa×s | 425.31 | Joback Calculated Property |
| η | 0.0004103 | Pa×s | 467.14 | Joback Calculated Property |
| η | 0.0002853 | Pa×s | 508.97 | Joback Calculated Property |
| η | 0.0002097 | Pa×s | 550.80 | Joback Calculated Property |
| η | 0.0001609 | Pa×s | 592.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Bromobutyric acid, 4-methoxy-2-methylbutyl ester.
Sources
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