- InChI
- InChI=1S/C10H18O2/c1-7(2)5-6-9(8(3)4)10(11)12/h8-9H,1,5-6H2,2-4H3,(H,11,12)
- InChI Key
- NVOBEWKGWWJTOA-UHFFFAOYSA-N
- Formula
- C10H18O2
- SMILES
- C=C(C)CCC(C(=O)O)C(C)C
- Molecular Weight1
- 170.25
- 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).
- I : Polar retention indices.
- 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° | -158.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -409.46 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.91 | kJ/mol | Joback Calculated Property |
| log10WS | -2.48 | Crippen Calculated Property | |
| logPoct/wat | 2.700 | Crippen Calculated Property | |
| McVol | 154.900 | ml/mol | McGowan Calculated Property |
| Pc | 2603.08 | kPa | Joback Calculated Property |
| I | 2132.00 | NIST | |
| Tboil | 569.93 | K | Joback Calculated Property |
| Tc | 748.12 | K | Joback Calculated Property |
| Tfus | 267.49 | K | Joback Calculated Property |
| Vc | 0.591 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [383.15; 449.98] | J/mol×K | [569.93; 748.12] | 
|
| Cp,gas | 383.15 | J/mol×K | 569.93 | Joback Calculated Property |
| Cp,gas | 395.70 | J/mol×K | 599.63 | Joback Calculated Property |
| Cp,gas | 407.66 | J/mol×K | 629.33 | Joback Calculated Property |
| Cp,gas | 419.05 | J/mol×K | 659.03 | Joback Calculated Property |
| Cp,gas | 429.88 | J/mol×K | 688.72 | Joback Calculated Property |
| Cp,gas | 440.19 | J/mol×K | 718.42 | Joback Calculated Property |
| Cp,gas | 449.98 | J/mol×K | 748.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Isopropyl-5-methylhex-5-enoic acid.
Sources
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