- InChI
- InChI=1S/C7H11BrO2/c1-5(9)10-7-4-2-3-6(7)8/h6-7H,2-4H2,1H3/t6-,7-/m1/s1
- InChI Key
- RWFKZZAXUPSAQT-RNFRBKRXSA-N
- Formula
- C7H11BrO2
- SMILES
- CC(=O)OC1CCCC1Br
- Molecular Weight1
- 207.06
- CAS
- 53093-42-8
- 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).
- IE : Ionization energy (eV).
- 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° | -182.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -366.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.72 | kJ/mol | Joback Calculated Property |
| IE | 10.07 ± 0.02 | eV | NIST |
| log10WS | -2.17 | Crippen Calculated Property | |
| logPoct/wat | 1.865 | Crippen Calculated Property | |
| McVol | 123.570 | ml/mol | McGowan Calculated Property |
| Pc | 3773.04 | kPa | Joback Calculated Property |
| Tboil | 512.62 | K | Joback Calculated Property |
| Tc | 735.30 | K | Joback Calculated Property |
| Tfus | 307.27 | K | Joback Calculated Property |
| Vc | 0.454 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [262.46; 334.10] | J/mol×K | [512.62; 735.30] | 
|
| Cp,gas | 262.46 | J/mol×K | 512.62 | Joback Calculated Property |
| Cp,gas | 276.29 | J/mol×K | 549.73 | Joback Calculated Property |
| Cp,gas | 289.34 | J/mol×K | 586.85 | Joback Calculated Property |
| Cp,gas | 301.63 | J/mol×K | 623.96 | Joback Calculated Property |
| Cp,gas | 313.18 | J/mol×K | 661.07 | Joback Calculated Property |
| Cp,gas | 324.00 | J/mol×K | 698.19 | Joback Calculated Property |
| Cp,gas | 334.10 | J/mol×K | 735.30 | Joback Calculated Property |
| η | [0.0004326; 0.0023129] | Pa×s | [307.27; 512.62] |
|
| η | 0.0023129 | Pa×s | 307.27 | Joback Calculated Property |
| η | 0.0015206 | Pa×s | 341.50 | Joback Calculated Property |
| η | 0.0010791 | Pa×s | 375.72 | Joback Calculated Property |
| η | 0.0008109 | Pa×s | 409.94 | Joback Calculated Property |
| η | 0.0006368 | Pa×s | 444.17 | Joback Calculated Property |
| η | 0.0005177 | Pa×s | 478.39 | Joback Calculated Property |
| η | 0.0004326 | Pa×s | 512.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentanol,2-bromo-,acetate,trans-.
Sources
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