- InChI
- InChI=1S/C24H46O4/c1-3-5-7-9-11-13-15-17-19-21-23(25)27-28-24(26)22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3
- InChI Key
- YIVJZNGAASQVEM-UHFFFAOYSA-N
- Formula
- C24H46O4
- SMILES
-
CCCCCCCCCCCC(=O)OOC(=O)CCCCCCC
CCCC - Molecular Weight1
- 398.63
- CAS
- 105-74-8
- 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).
- 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 | 1.2666 | Relay (1.0) Calculated Property | |
| ΔfG° | -469.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -977.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 66.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 128.15 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.84 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.830 | Crippen Calculated Property | |
| McVol | 363.900 | ml/mol | McGowan Calculated Property |
| Pc | 810.76 | kPa | Joback Calculated Property |
| Tboil | 632.26 | K | Relay (1.0) Calculated Property |
| Tc | 808.07 | K | Relay (1.0) Calculated Property |
| Tfus | 325.65 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Vc | 1.431 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [547.29; 1273.73] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 3.18900e+01 | |||
| Coefficient B | 2.17424e+00 | |||
| Coefficient C | -1.09260e-03 | |||
| Coefficient D | 1.60200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 547.29 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 671.43 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 783.54 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 884.11 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 973.66 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1052.69 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1121.70 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1181.21 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1231.72 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1273.73 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0138744; 0.0000433] | Pa×s | [325.65; 741.80] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.45640e+01 | |||
| Coefficient B | 3.34972e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 325.65 | |||
| Temperature range, max. | 741.80 | |||
| η | 0.0138744 | Pa×s | 325.65 | Calculated Property |
| η | 0.0038617 | Pa×s | 371.89 | Calculated Property |
| η | 0.0014262 | Pa×s | 418.13 | Calculated Property |
| η | 0.0006423 | Pa×s | 464.37 | Calculated Property |
| η | 0.0003342 | Pa×s | 510.60 | Calculated Property |
| η | 0.0001939 | Pa×s | 556.84 | Calculated Property |
| η | 0.0001222 | Pa×s | 603.08 | Calculated Property |
| η | 0.0000823 | Pa×s | 649.32 | Calculated Property |
| η | 0.0000584 | Pa×s | 695.56 | Calculated Property |
| η | 0.0000433 | Pa×s | 741.80 | Calculated Property |
Similar Compounds
Find more compounds similar to Lauroyl peroxide.
Sources
- Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
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