- InChI
- InChI=1S/C5H9BrO2/c6-4-2-1-3-5(7)8/h1-4H2,(H,7,8)
- InChI Key
- WNXNUPJZWYOKMW-UHFFFAOYSA-N
- Formula
- C5H9BrO2
- SMILES
- O=C(O)CCCCBr
- Molecular Weight1
- 181.03
- CAS
- 2067-33-6
- Other Names
-
- 5-Bromovaleric acid
- 5-Bromopentanoic acid
- 2-Bromovaleric acid
- 5-Bromo-n-valeric acid
- «delta»-Bromovaleric acid
- Valeric acid, 5-bromo-
- 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° | -260.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -385.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.58 | kJ/mol | Joback Calculated Property |
| log10WS | -1.45 | Crippen Calculated Property | |
| logPoct/wat | 1.636 | Crippen Calculated Property | |
| McVol | 106.250 | ml/mol | McGowan Calculated Property |
| Pc | 4602.62 | kPa | Joback Calculated Property |
| Tboil | 526.01 | K | Joback Calculated Property |
| Tc | 713.17 | K | Joback Calculated Property |
| Tfus | 316.66 | K | Joback Calculated Property |
| Vc | 0.403 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [214.72; 253.83] | J/mol×K | [526.01; 713.17] | 
|
| Cp,gas | 214.72 | J/mol×K | 526.01 | Joback Calculated Property |
| Cp,gas | 222.13 | J/mol×K | 557.20 | Joback Calculated Property |
| Cp,gas | 229.16 | J/mol×K | 588.40 | Joback Calculated Property |
| Cp,gas | 235.83 | J/mol×K | 619.59 | Joback Calculated Property |
| Cp,gas | 242.15 | J/mol×K | 650.78 | Joback Calculated Property |
| Cp,gas | 248.15 | J/mol×K | 681.98 | Joback Calculated Property |
| Cp,gas | 253.83 | J/mol×K | 713.17 | Joback Calculated Property |
| η | [0.0002075; 0.0093719] | Pa×s | [316.66; 526.01] |
|
| η | 0.0093719 | Pa×s | 316.66 | Joback Calculated Property |
| η | 0.0036236 | Pa×s | 351.55 | Joback Calculated Property |
| η | 0.0016633 | Pa×s | 386.44 | Joback Calculated Property |
| η | 0.0008686 | Pa×s | 421.33 | Joback Calculated Property |
| η | 0.0005010 | Pa×s | 456.23 | Joback Calculated Property |
| η | 0.0003124 | Pa×s | 491.12 | Joback Calculated Property |
| η | 0.0002075 | Pa×s | 526.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentanoic acid, 5-bromo-.
Sources
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