- InChI
- InChI=1S/C25H50O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-25-26/h25H,2-24H2,1H3
- InChI Key
- QTEHJNWMBFAIIT-UHFFFAOYSA-N
- Formula
- C25H50O2
- SMILES
- CCCCCCCCCCCCCCCCCCCCCCCCOC=O
- Molecular Weight1
- 382.66
- 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 | 1.1677 | Relay (1.0) Calculated Property | |
| ΔfG° | -98.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -828.92 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 66.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 134.46 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.36 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.762 | Crippen Calculated Property | |
| McVol | 370.550 | ml/mol | McGowan Calculated Property |
| Pc | 771.18 | kPa | Joback Calculated Property |
| Inp | [2728.00; 2728.00] |
|
|
| Inp | 2728.00 | NIST | |
| Inp | 2728.00 | NIST | |
| Tboil | 632.00 | K | Relay (1.0) Calculated Property |
| Tc | 819.04 | K | Relay (1.0) Calculated Property |
| Tfus | 327.57 | K | Relay (1.0) Calculated Property |
| Vc | 1.463 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [546.65; 1301.08] | 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 | -1.48370e+01 | |||
| Coefficient B | 2.42712e+00 | |||
| Coefficient C | -1.44900e-03 | |||
| Coefficient D | 3.37800e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 546.65 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 677.43 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 793.97 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 897.36 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 988.65 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1068.92 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1139.22 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1200.64 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1254.24 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1301.08 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0015443; 0.0001422] | Pa×s | [430.21; 710.73] |
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 | -1.25168e+01 | |||
| Coefficient B | 2.60003e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 430.21 | |||
| Temperature range, max. | 710.73 | |||
| η | 0.0015443 | Pa×s | 430.21 | Calculated Property |
| η | 0.0010266 | Pa×s | 461.38 | Calculated Property |
| η | 0.0007187 | Pa×s | 492.55 | Calculated Property |
| η | 0.0005249 | Pa×s | 523.72 | Calculated Property |
| η | 0.0003972 | Pa×s | 554.89 | Calculated Property |
| η | 0.0003096 | Pa×s | 586.06 | Calculated Property |
| η | 0.0002474 | Pa×s | 617.23 | Calculated Property |
| η | 0.0002021 | Pa×s | 648.39 | Calculated Property |
| η | 0.0001681 | Pa×s | 679.56 | Calculated Property |
| η | 0.0001422 | Pa×s | 710.73 | Calculated Property |
Similar Compounds
Find more compounds similar to Tetracosanyl formate.
Sources
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