- InChI
- InChI=1S/C11H19BrO2/c1-10(2)7-9-14-11(13)6-4-3-5-8-12/h7H,3-6,8-9H2,1-2H3
- InChI Key
- ABOMUFFETKXHAQ-UHFFFAOYSA-N
- Formula
- C11H19BrO2
- SMILES
- CC(C)=CCOC(=O)CCCCCBr
- Molecular Weight1
- 263.17
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -106.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -381.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.71 | kJ/mol | Joback Calculated Property |
| log10WS | -3.57 | Crippen Calculated Property | |
| logPoct/wat | 3.451 | Crippen Calculated Property | |
| McVol | 186.490 | ml/mol | McGowan Calculated Property |
| Pc | 2263.26 | kPa | Joback Calculated Property |
| Tboil | 597.57 | K | Joback Calculated Property |
| Tc | 791.27 | K | Joback Calculated Property |
| Tfus | 326.65 | K | Joback Calculated Property |
| Vc | 0.719 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [441.63; 515.57] | J/mol×K | [597.57; 791.27] | 
|
| Cp,gas | 441.63 | J/mol×K | 597.57 | Joback Calculated Property |
| Cp,gas | 455.62 | J/mol×K | 629.85 | Joback Calculated Property |
| Cp,gas | 468.92 | J/mol×K | 662.14 | Joback Calculated Property |
| Cp,gas | 481.53 | J/mol×K | 694.42 | Joback Calculated Property |
| Cp,gas | 493.49 | J/mol×K | 726.70 | Joback Calculated Property |
| Cp,gas | 504.82 | J/mol×K | 758.99 | Joback Calculated Property |
| Cp,gas | 515.57 | J/mol×K | 791.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 6-Bromohexanoic acid, 3-methylbut-2-enyl ester.
Sources
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