- InChI
- InChI=1S/C10H19O2/c1-3-5-7-9(10(11)12)8-6-4-2/h9H,3-8H2,1-2H3
- InChI Key
- KQYRYPXQPKPVSP-UHFFFAOYSA-N
- Formula
- C10H19O2
- SMILES
- CCCCC(CCCC)C([O])=O
- Molecular Weight1
- 171.26
- Other Names
-
- 2-Butylhexanoic acid
- Dibutylacetic acid
- Isocarb 10
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 |
|---|---|---|---|
| ω | 0.6421 | Relay (1.0) Calculated Property | |
| ΔfG° | -256.94 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -576.17 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 55.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.69 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.940 | Crippen Calculated Property | |
| McVol | 157.050 | ml/mol | McGowan Calculated Property |
| Pc | 2260.56 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 487.26 | K | Relay (1.0) Calculated Property |
| Tc | 676.43 | K | Relay (1.0) Calculated Property |
| Tfus | 208.05 | K | Relay (1.0) Calculated Property |
| Vc | 0.590 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
![Spiro[5.5]undecane-3-carboxylic acid.](data:image/png;base64,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)
Find more compounds similar to Hexanoic acid, 2-butyl-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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