- InChI
- InChI=1S/C12H22O2/c1-10(2)6-3-4-7-11-8-5-9-12(13)14-11/h10-11H,3-9H2,1-2H3
- InChI Key
- HORZJHMTLLMPDU-UHFFFAOYSA-N
- Formula
- C12H22O2
- SMILES
- CC(C)CCCCC1CCCC(=O)O1
- Molecular Weight1
- 198.30
- 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).
- Inp : Non-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° | -136.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -511.67 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.10 | kJ/mol | Joback Calculated Property |
| log10WS | -3.47 | Crippen Calculated Property | |
| logPoct/wat | 3.298 | Crippen Calculated Property | |
| McVol | 176.520 | ml/mol | McGowan Calculated Property |
| Pc | 2202.08 | kPa | Joback Calculated Property |
| Inp | 1687.00 | NIST | |
| Tboil | 587.84 | K | Joback Calculated Property |
| Tc | 797.25 | K | Joback Calculated Property |
| Tfus | 312.17 | K | Joback Calculated Property |
| Vc | 0.662 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [471.91; 576.08] | J/mol×K | [587.84; 797.25] | 
|
| Cp,gas | 471.91 | J/mol×K | 587.84 | Joback Calculated Property |
| Cp,gas | 491.82 | J/mol×K | 622.74 | Joback Calculated Property |
| Cp,gas | 510.70 | J/mol×K | 657.64 | Joback Calculated Property |
| Cp,gas | 528.56 | J/mol×K | 692.54 | Joback Calculated Property |
| Cp,gas | 545.41 | J/mol×K | 727.44 | Joback Calculated Property |
| Cp,gas | 561.25 | J/mol×K | 762.34 | Joback Calculated Property |
| Cp,gas | 576.08 | J/mol×K | 797.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 10-Methylundecan-5-olide.
Sources
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