- InChI
- InChI=1S/C15H26O2/c1-7-11(4)14(16)13(6)15(17)12(5)9-8-10(2)3/h8,11-13H,7,9H2,1-6H3
- InChI Key
- BZBFBQMTXDLSPW-UHFFFAOYSA-N
- Formula
- C15H26O2
- SMILES
-
CCC(C)C(=O)C(C)C(=O)C(C)CC=C(C
)C - Molecular Weight1
- 238.37
- CAS
- 13851-08-6
- Other Names
-
- 3,5,7,10-tetramethylundec-9-ene-4,6-dione
- 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.
- 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° | -118.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -486.50 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.35 | kJ/mol | Joback Calculated Property |
| log10WS | -3.79 | Crippen Calculated Property | |
| logPoct/wat | 3.799 | Crippen Calculated Property | |
| McVol | 221.050 | ml/mol | McGowan Calculated Property |
| Pc | 1664.61 | kPa | Joback Calculated Property |
| Inp | [1553.00; 1582.70] |
|
|
| Inp | 1582.70 | NIST | |
| Inp | 1553.00 | NIST | |
| Inp | 1557.00 | NIST | |
| Inp | 1582.70 | NIST | |
| Inp | 1553.00 | NIST | |
| I | [1950.00; 1950.00] |
|
|
| I | 1950.00 | NIST | |
| I | 1950.00 | NIST | |
| I | 1950.00 | NIST | |
| Tboil | 653.06 | K | Joback Calculated Property |
| Tc | 845.30 | K | Joback Calculated Property |
| Tfus | 294.63 | K | Joback Calculated Property |
| Vc | 0.851 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [598.33; 688.59] | J/mol×K | [653.06; 845.30] |
|
| Cp,gas | 598.33 | J/mol×K | 653.06 | Joback Calculated Property |
| Cp,gas | 615.53 | J/mol×K | 685.10 | Joback Calculated Property |
| Cp,gas | 631.82 | J/mol×K | 717.14 | Joback Calculated Property |
| Cp,gas | 647.23 | J/mol×K | 749.18 | Joback Calculated Property |
| Cp,gas | 661.80 | J/mol×K | 781.22 | Joback Calculated Property |
| Cp,gas | 675.58 | J/mol×K | 813.26 | Joback Calculated Property |
| Cp,gas | 688.59 | J/mol×K | 845.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,5,7,10-Tetramethylundec-9-en-4,6-dione.
Sources
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