- InChI
- InChI=1S/C10H18O2/c1-3-4-7-10(2)8-5-6-9(11)12-10/h3-8H2,1-2H3
- InChI Key
- MPQRKJBKDZBMLT-UHFFFAOYSA-N
- Formula
- C10H18O2
- SMILES
- CCCCC1(C)CCCC(=O)O1
- Molecular Weight1
- 170.25
- ω : Acentric Factor.
- 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).
- 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).
- Inp : Non-polar retention indices.
- 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 |
|---|---|---|---|
| ω | 0.4857 | Relay (1.0) Calculated Property | |
| ΔfG° | -156.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -532.82 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.04 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.662 | Crippen Calculated Property | |
| McVol | 148.340 | ml/mol | McGowan Calculated Property |
| Pc | 2764.26 | kPa | Joback Calculated Property |
| Inp | 1397.00 | NIST | |
| I | [2050.00; 2050.00] |
|
|
| I | 2050.00 | NIST | |
| I | 2050.00 | NIST | |
| Tboil | 545.78 | K | Relay (1.0) Calculated Property |
| Tc | 713.23 | K | Relay (1.0) Calculated Property |
| Tfus | 224.22 | K | Relay (1.0) Calculated Property |
| Vc | 0.539 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [370.32; 465.57] | J/mol×K | [542.76; 763.32] |
|
| Cp,gas | 370.32 | J/mol×K | 542.76 | Joback Calculated Property |
| Cp,gas | 388.37 | J/mol×K | 579.52 | Joback Calculated Property |
| Cp,gas | 405.43 | J/mol×K | 616.28 | Joback Calculated Property |
| Cp,gas | 421.60 | J/mol×K | 653.04 | Joback Calculated Property |
| Cp,gas | 436.95 | J/mol×K | 689.80 | Joback Calculated Property |
| Cp,gas | 451.58 | J/mol×K | 726.56 | Joback Calculated Property |
| Cp,gas | 465.57 | J/mol×K | 763.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Methyl-5-nonanolide.
Sources
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