- InChI
- InChI=1S/C23H46O/c1-3-5-7-9-11-13-15-17-19-21-23(24)22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3
- InChI Key
- VARQGBHBYZTYLJ-UHFFFAOYSA-N
- Formula
- C23H46O
- SMILES
- CCCCCCCCCCCC(=O)CCCCCCCCCCC
- Molecular Weight1
- 338.61
- CAS
- 540-09-0
- Other Names
-
- Diundecyl ketone
- Lauron
- Laurone
- Undecyl ketone
- di-n-Undecyl ketone
- tricosan-12-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).
- Pvap : Vapor 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° | 13.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -630.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.54 | kJ/mol | Joback Calculated Property |
| log10WS | -8.73 | Crippen Calculated Property | |
| logPoct/wat | 8.397 | Crippen Calculated Property | |
| McVol | 336.500 | ml/mol | McGowan Calculated Property |
| Pc | 884.19 | kPa | Joback Calculated Property |
| Tboil | 779.51 | K | Joback Calculated Property |
| Tc | 956.06 | K | Joback Calculated Property |
| Tfus | 342.00 ± 0.50 | K | NIST |
| Vc | 1.329 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1059.34; 1171.91] | J/mol×K | [779.51; 956.06] | 
|
| Cp,gas | 1059.34 | J/mol×K | 779.51 | Joback Calculated Property |
| Cp,gas | 1080.54 | J/mol×K | 808.93 | Joback Calculated Property |
| Cp,gas | 1100.72 | J/mol×K | 838.36 | Joback Calculated Property |
| Cp,gas | 1119.90 | J/mol×K | 867.78 | Joback Calculated Property |
| Cp,gas | 1138.14 | J/mol×K | 897.21 | Joback Calculated Property |
| Cp,gas | 1155.46 | J/mol×K | 926.63 | Joback Calculated Property |
| Cp,gas | 1171.91 | J/mol×K | 956.06 | Joback Calculated Property |
| η | [0.0000642; 0.0017989] | Pa×s | [398.90; 779.51] |
|
| η | 0.0017989 | Pa×s | 398.90 | Joback Calculated Property |
| η | 0.0007053 | Pa×s | 462.33 | Joback Calculated Property |
| η | 0.0003466 | Pa×s | 525.77 | Joback Calculated Property |
| η | 0.0001985 | Pa×s | 589.20 | Joback Calculated Property |
| η | 0.0001267 | Pa×s | 652.64 | Joback Calculated Property |
| η | 0.0000875 | Pa×s | 716.08 | Joback Calculated Property |
| η | 0.0000642 | Pa×s | 779.51 | Joback Calculated Property |
| ΔfusH | [78.03; 78.03] | kJ/mol | [342.20; 342.20] |
|
| ΔfusH | 78.03 | kJ/mol | 342.20 | NIST |
| ΔfusH | 78.03 | kJ/mol | 342.20 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [520.12; 709.15] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.56923e+01 | |||
| Coefficient B | -6.01682e+03 | |||
| Coefficient C | -1.29537e+02 | |||
| Temperature range, min. | 520.12 | |||
| Temperature range, max. | 709.15 | |||
| Pvap | 1.33 | kPa | 520.12 | Calculated Property |
| Pvap | 2.93 | kPa | 541.12 | Calculated Property |
| Pvap | 5.95 | kPa | 562.13 | Calculated Property |
| Pvap | 11.33 | kPa | 583.13 | Calculated Property |
| Pvap | 20.38 | kPa | 604.13 | Calculated Property |
| Pvap | 34.88 | kPa | 625.14 | Calculated Property |
| Pvap | 57.13 | kPa | 646.14 | Calculated Property |
| Pvap | 90.06 | kPa | 667.14 | Calculated Property |
| Pvap | 137.17 | kPa | 688.15 | Calculated Property |
| Pvap | 202.66 | kPa | 709.15 | Calculated Property |
Similar Compounds
Find more compounds similar to 12-Tricosanone.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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