- InChI
- InChI=1S/C16H30O2/c1-15-12-10-8-6-4-2-3-5-7-9-11-13-16(17)18-14-15/h15H,2-14H2,1H3
- InChI Key
- BXUAFPXADZNGNU-UHFFFAOYSA-N
- Formula
- C16H30O2
- SMILES
- CC1CCCCCCCCCCCCC(=O)OC1
- Molecular Weight1
- 254.41
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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 | 0.3717 | Relay (1.0) Calculated Property | |
| ΔfG° | -298.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -667.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.77 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.861 | Crippen Calculated Property | |
| McVol | 232.880 | ml/mol | McGowan Calculated Property |
| Pc | 1820.06 | kPa | Joback Calculated Property |
| Inp | [1877.00; 1877.00] |
|
|
| Inp | 1877.00 | NIST | |
| Inp | 1877.00 | NIST | |
| I | [2253.00; 2253.00] |
|
|
| I | 2253.00 | NIST | |
| I | 2253.00 | NIST | |
| Tboil | 672.56 | K | Relay (1.0) Calculated Property |
| Tc | 848.58 | K | Relay (1.0) Calculated Property |
| Tfus | 297.50 | K | Relay (1.0) Calculated Property |
| Vc | 0.755 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [687.81; 824.34] | J/mol×K | [677.61; 916.35] |
|
| Cp,gas | 687.81 | J/mol×K | 677.61 | Joback Calculated Property |
| Cp,gas | 716.19 | J/mol×K | 717.40 | Joback Calculated Property |
| Cp,gas | 742.37 | J/mol×K | 757.19 | Joback Calculated Property |
| Cp,gas | 766.32 | J/mol×K | 796.98 | Joback Calculated Property |
| Cp,gas | 787.99 | J/mol×K | 836.77 | Joback Calculated Property |
| Cp,gas | 807.34 | J/mol×K | 876.56 | Joback Calculated Property |
| Cp,gas | 824.34 | J/mol×K | 916.35 | Joback Calculated Property |
| η | [0.0000100; 0.0266519] | Pa×s | [291.63; 677.61] |
|
| η | 0.0266519 | Pa×s | 291.63 | Joback Calculated Property |
| η | 0.0021827 | Pa×s | 355.96 | Joback Calculated Property |
| η | 0.0003845 | Pa×s | 420.29 | Joback Calculated Property |
| η | 0.0001074 | Pa×s | 484.62 | Joback Calculated Property |
| η | 0.0000405 | Pa×s | 548.95 | Joback Calculated Property |
| η | 0.0000187 | Pa×s | 613.28 | Joback Calculated Property |
| η | 0.0000100 | Pa×s | 677.61 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 14-Methylpentadecano-15-lactone.
Sources
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