- InChI
- InChI=1S/C42H86/c1-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-29-31-33-35-38-42(4)40-36-39-41(3)37-34-32-30-28-16-14-12-10-8-6-2/h41-42H,5-40H2,1-4H3
- InChI Key
- NRPYVYLIJXSJHE-UHFFFAOYSA-N
- Formula
- C42H86
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCC(C)CCC
C(C)CCCCCCCCCCCC - Molecular Weight1
- 591.13
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 297.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -920.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 97.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.31 | kJ/mol | Joback Calculated Property |
| log10WS | -16.92 | Crippen Calculated Property | |
| logPoct/wat | 16.342 | Crippen Calculated Property | |
| McVol | 602.640 | ml/mol | McGowan Calculated Property |
| Pc | 365.03 | kPa | Joback Calculated Property |
| Inp | 4049.00 | NIST | |
| Tboil | 1159.48 | K | Joback Calculated Property |
| Tc | 1578.86 | K | Joback Calculated Property |
| Tfus | 533.10 | K | Joback Calculated Property |
| Vc | 2.376 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [2317.64; 2552.67] | J/mol×K | [1159.48; 1578.86] | 
|
| Cp,gas | 2317.64 | J/mol×K | 1159.48 | Joback Calculated Property |
| Cp,gas | 2364.94 | J/mol×K | 1229.38 | Joback Calculated Property |
| Cp,gas | 2407.66 | J/mol×K | 1299.27 | Joback Calculated Property |
| Cp,gas | 2446.79 | J/mol×K | 1369.17 | Joback Calculated Property |
| Cp,gas | 2483.33 | J/mol×K | 1439.06 | Joback Calculated Property |
| Cp,gas | 2518.29 | J/mol×K | 1508.96 | Joback Calculated Property |
| Cp,gas | 2552.67 | J/mol×K | 1578.86 | Joback Calculated Property |
| η | [0.0000029; 0.0002380] | Pa×s | [533.10; 1159.48] |
|
| η | 0.0002380 | Pa×s | 533.10 | Joback Calculated Property |
| η | 0.0000627 | Pa×s | 637.50 | Joback Calculated Property |
| η | 0.0000241 | Pa×s | 741.89 | Joback Calculated Property |
| η | 0.0000117 | Pa×s | 846.29 | Joback Calculated Property |
| η | 0.0000067 | Pa×s | 950.69 | Joback Calculated Property |
| η | 0.0000042 | Pa×s | 1055.08 | Joback Calculated Property |
| η | 0.0000029 | Pa×s | 1159.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Tetracontane, 13,17-dimethyl.
Sources
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