- InChI
- InChI=1S/C26H50O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-26(27)24-19-22-25-20-17-18-21-25/h25H,2-24H2,1H3
- InChI Key
- MEDPYMMZEVIBCH-UHFFFAOYSA-N
- Formula
- C26H50O
- SMILES
-
CCCCCCCCCCCCCCCCCC(=O)CCCC1CCC
C1 - Molecular Weight1
- 378.67
- CAS
- 56247-96-2
- 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).
- 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).
- 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° | 75.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -632.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.47 | kJ/mol | Joback Calculated Property |
| log10WS | -9.64 | Crippen Calculated Property | |
| logPoct/wat | 9.178 | Crippen Calculated Property | |
| McVol | 367.910 | ml/mol | McGowan Calculated Property |
| Pc | 830.02 | kPa | Joback Calculated Property |
| Tboil | 863.43 | K | Joback Calculated Property |
| Tc | 1057.55 | K | Joback Calculated Property |
| Tfus | 326.65 ± 2.00 | K | NIST |
| Vc | 1.438 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1245.45; 1363.88] | J/mol×K | [863.43; 1057.55] | 
|
| Cp,gas | 1245.45 | J/mol×K | 863.43 | Joback Calculated Property |
| Cp,gas | 1268.19 | J/mol×K | 895.78 | Joback Calculated Property |
| Cp,gas | 1289.64 | J/mol×K | 928.14 | Joback Calculated Property |
| Cp,gas | 1309.87 | J/mol×K | 960.49 | Joback Calculated Property |
| Cp,gas | 1328.94 | J/mol×K | 992.85 | Joback Calculated Property |
| Cp,gas | 1346.92 | J/mol×K | 1025.20 | Joback Calculated Property |
| Cp,gas | 1363.88 | J/mol×K | 1057.55 | Joback Calculated Property |
| η | [0.0000626; 0.0015282] | Pa×s | [443.61; 863.43] |
|
| η | 0.0015282 | Pa×s | 443.61 | Joback Calculated Property |
| η | 0.0006242 | Pa×s | 513.58 | Joback Calculated Property |
| η | 0.0003160 | Pa×s | 583.55 | Joback Calculated Property |
| η | 0.0001851 | Pa×s | 653.52 | Joback Calculated Property |
| η | 0.0001202 | Pa×s | 723.49 | Joback Calculated Property |
| η | 0.0000843 | Pa×s | 793.46 | Joback Calculated Property |
| η | 0.0000626 | Pa×s | 863.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Heneicosanone, 1-cyclopentyl-.
Sources
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