- InChI
- InChI=1S/C25H50O/c1-3-5-7-9-11-13-15-17-19-21-23-25(26)24-22-20-18-16-14-12-10-8-6-4-2/h3-24H2,1-2H3
- InChI Key
- VTPOKROHHTWTML-UHFFFAOYSA-N
- Formula
- C25H50O
- SMILES
- CCCCCCCCCCCCC(=O)CCCCCCCCCCCC
- Molecular Weight1
- 366.66
- CAS
- 2123-19-5
- Other Names
-
- pentacosan-13-one
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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° | 30.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -671.91 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.99 | kJ/mol | Joback Calculated Property |
| log10WS | -9.57 | Crippen Calculated Property | |
| logPoct/wat | 9.178 | Crippen Calculated Property | |
| McVol | 364.680 | ml/mol | McGowan Calculated Property |
| Pc | 791.26 | kPa | Joback Calculated Property |
| Tboil | 825.27 | K | Joback Calculated Property |
| Tc | 1010.36 | K | Joback Calculated Property |
| Tfus | 421.44 | K | Joback Calculated Property |
| Vc | 1.442 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1186.13; 1303.74] | J/mol×K | [825.27; 1010.36] | 
|
| Cp,gas | 1186.13 | J/mol×K | 825.27 | Joback Calculated Property |
| Cp,gas | 1208.45 | J/mol×K | 856.12 | Joback Calculated Property |
| Cp,gas | 1229.62 | J/mol×K | 886.97 | Joback Calculated Property |
| Cp,gas | 1249.68 | J/mol×K | 917.82 | Joback Calculated Property |
| Cp,gas | 1268.69 | J/mol×K | 948.66 | Joback Calculated Property |
| Cp,gas | 1286.70 | J/mol×K | 979.51 | Joback Calculated Property |
| Cp,gas | 1303.74 | J/mol×K | 1010.36 | Joback Calculated Property |
| η | [0.0000484; 0.0014199] | Pa×s | [421.44; 825.27] |
|
| η | 0.0014199 | Pa×s | 421.44 | Joback Calculated Property |
| η | 0.0005486 | Pa×s | 488.75 | Joback Calculated Property |
| η | 0.0002668 | Pa×s | 556.05 | Joback Calculated Property |
| η | 0.0001516 | Pa×s | 623.36 | Joback Calculated Property |
| η | 0.0000962 | Pa×s | 690.66 | Joback Calculated Property |
| η | 0.0000662 | Pa×s | 757.96 | Joback Calculated Property |
| η | 0.0000484 | Pa×s | 825.27 | Joback Calculated Property |
| ΔfusH | 96.17 | kJ/mol | 347.00 | NIST |
Similar Compounds
Find more compounds similar to 13-Pentacosanone.
Sources
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