- InChI
- InChI=1S/C12H20O2/c1-10(2)6-4-3-5-7-11-8-9-12(13)14-11/h8,10H,3-7,9H2,1-2H3
- InChI Key
- YPYMVGCVXHDWKK-UHFFFAOYSA-N
- Formula
- C12H20O2
- SMILES
- CC(C)CCCCCC1=CCC(=O)O1
- Molecular Weight1
- 196.29
- 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° | -96.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -438.86 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.19 | kJ/mol | Joback Calculated Property |
| log10WS | -3.71 | Crippen Calculated Property | |
| logPoct/wat | 3.424 | Crippen Calculated Property | |
| McVol | 172.220 | ml/mol | McGowan Calculated Property |
| Pc | 2263.26 | kPa | Joback Calculated Property |
| Inp | 1550.00 | NIST | |
| Tboil | 592.38 | K | Joback Calculated Property |
| Tc | 797.88 | K | Joback Calculated Property |
| Tfus | 333.21 | K | Joback Calculated Property |
| Vc | 0.657 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [448.83; 539.22] | J/mol×K | [592.38; 797.88] | 
|
| Cp,gas | 448.83 | J/mol×K | 592.38 | Joback Calculated Property |
| Cp,gas | 466.02 | J/mol×K | 626.63 | Joback Calculated Property |
| Cp,gas | 482.35 | J/mol×K | 660.88 | Joback Calculated Property |
| Cp,gas | 497.82 | J/mol×K | 695.13 | Joback Calculated Property |
| Cp,gas | 512.45 | J/mol×K | 729.38 | Joback Calculated Property |
| Cp,gas | 526.24 | J/mol×K | 763.63 | Joback Calculated Property |
| Cp,gas | 539.22 | J/mol×K | 797.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 10-Methylundec-3-en-4-olide.
Sources
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