- InChI
- InChI=1S/C23H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-23(2)24/h3-22H2,1-2H3
- InChI Key
- HHIFOCFPEAIUAV-UHFFFAOYSA-N
- Formula
- C23H46O2
- SMILES
- CCCCCCCCCCCCCCCCCCCCCOC(C)=O
- Molecular Weight1
- 354.62
- Other Names
-
- n-Heneicosyl acetate
- 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.
- 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 | 1.0708 | Relay (1.0) Calculated Property | |
| ΔfG° | -167.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -846.06 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 59.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 121.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.87 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.981 | Crippen Calculated Property | |
| McVol | 342.370 | ml/mol | McGowan Calculated Property |
| Pc | 854.46 | kPa | Joback Calculated Property |
| Inp | 2509.20 | NIST | |
| Tboil | 614.00 | K | Relay (1.0) Calculated Property |
| Tc | 797.20 | K | Relay (1.0) Calculated Property |
| Tfus | 316.30 | K | Relay (1.0) Calculated Property |
| Vc | 1.357 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1083.22; 1194.25] | J/mol×K | [784.06; 960.84] | 
|
| Cp,gas | 1083.22 | J/mol×K | 784.06 | Joback Calculated Property |
| Cp,gas | 1104.36 | J/mol×K | 813.52 | Joback Calculated Property |
| Cp,gas | 1124.41 | J/mol×K | 842.99 | Joback Calculated Property |
| Cp,gas | 1143.38 | J/mol×K | 872.45 | Joback Calculated Property |
| Cp,gas | 1161.33 | J/mol×K | 901.92 | Joback Calculated Property |
| Cp,gas | 1178.28 | J/mol×K | 931.38 | Joback Calculated Property |
| Cp,gas | 1194.25 | J/mol×K | 960.84 | Joback Calculated Property |
| η | [0.0000428; 0.0016765] | Pa×s | [391.30; 784.06] |
|
| η | 0.0016765 | Pa×s | 391.30 | Joback Calculated Property |
| η | 0.0005869 | Pa×s | 456.76 | Joback Calculated Property |
| η | 0.0002673 | Pa×s | 522.22 | Joback Calculated Property |
| η | 0.0001451 | Pa×s | 587.68 | Joback Calculated Property |
| η | 0.0000890 | Pa×s | 653.14 | Joback Calculated Property |
| η | 0.0000597 | Pa×s | 718.60 | Joback Calculated Property |
| η | 0.0000428 | Pa×s | 784.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heneicosyl acetate.
Sources
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