- InChI
- InChI=1S/C4H9BrO/c1-2-4(6)3-5/h4,6H,2-3H2,1H3
- InChI Key
- DMRXISNUOWIOKV-UHFFFAOYSA-N
- Formula
- C4H9BrO
- SMILES
- CCC(O)CBr
- Molecular Weight1
- 153.02
- CAS
- 2482-57-7
- ω : Acentric Factor.
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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 |
|---|---|---|---|
| ω | 0.5975 | Relay (1.0) Calculated Property | |
| ΔfG° | -142.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -299.30 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.29 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.17 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.152 | Crippen Calculated Property | |
| McVol | 90.590 | ml/mol | McGowan Calculated Property |
| Pc | 4869.76 | kPa | Joback Calculated Property |
| Tboil | 434.95 | K | Relay (1.0) Calculated Property |
| Tc | 625.34 | K | Relay (1.0) Calculated Property |
| Tfus | 217.60 | K | Relay (1.0) Calculated Property |
| Vc | 0.331 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [165.40; 203.81] | J/mol×K | [448.82; 632.13] | 
|
| Cp,gas | 165.40 | J/mol×K | 448.82 | Joback Calculated Property |
| Cp,gas | 172.61 | J/mol×K | 479.37 | Joback Calculated Property |
| Cp,gas | 179.48 | J/mol×K | 509.92 | Joback Calculated Property |
| Cp,gas | 186.02 | J/mol×K | 540.48 | Joback Calculated Property |
| Cp,gas | 192.25 | J/mol×K | 571.03 | Joback Calculated Property |
| Cp,gas | 198.17 | J/mol×K | 601.58 | Joback Calculated Property |
| Cp,gas | 203.81 | J/mol×K | 632.13 | Joback Calculated Property |
| η | [0.0002989; 0.0580626] | Pa×s | [240.46; 448.82] |
|
| η | 0.0580626 | Pa×s | 240.46 | Joback Calculated Property |
| η | 0.0138627 | Pa×s | 275.19 | Joback Calculated Property |
| η | 0.0045625 | Pa×s | 309.91 | Joback Calculated Property |
| η | 0.0018786 | Pa×s | 344.64 | Joback Calculated Property |
| η | 0.0009099 | Pa×s | 379.37 | Joback Calculated Property |
| η | 0.0004977 | Pa×s | 414.09 | Joback Calculated Property |
| η | 0.0002989 | Pa×s | 448.82 | Joback Calculated Property |
| ΔvapH | 58.40 | kJ/mol | 357.00 | NIST |
Similar Compounds
Find more compounds similar to 1-Bromo-2-butanol.
Sources
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