- InChI
- InChI=1S/C42H86/c1-7-9-11-13-15-17-19-21-23-25-27-32-40(4)34-29-36-42(6)38-30-37-41(5)35-28-33-39(3)31-26-24-22-20-18-16-14-12-10-8-2/h39-42H,7-38H2,1-6H3
- InChI Key
- YJNXZHUQBSZRBH-UHFFFAOYSA-N
- Formula
- C42H86
- SMILES
-
CCCCCCCCCCCCCC(C)CCCC(C)CCCC(C
)CCCC(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° | 293.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -931.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 90.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.53 | kJ/mol | Joback Calculated Property |
| log10WS | -16.44 | Crippen Calculated Property | |
| logPoct/wat | 16.054 | Crippen Calculated Property | |
| McVol | 602.640 | ml/mol | McGowan Calculated Property |
| Pc | 367.28 | kPa | Joback Calculated Property |
| Inp | 3807.00 | NIST | |
| Tboil | 1158.60 | K | Joback Calculated Property |
| Tc | 1560.30 | K | Joback Calculated Property |
| Tfus | 503.10 | K | Joback Calculated Property |
| Vc | 2.364 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [2317.22; 2539.27] | J/mol×K | [1158.60; 1560.30] | 
|
| Cp,gas | 2317.22 | J/mol×K | 1158.60 | Joback Calculated Property |
| Cp,gas | 2362.17 | J/mol×K | 1225.55 | Joback Calculated Property |
| Cp,gas | 2402.78 | J/mol×K | 1292.50 | Joback Calculated Property |
| Cp,gas | 2439.92 | J/mol×K | 1359.45 | Joback Calculated Property |
| Cp,gas | 2474.46 | J/mol×K | 1426.40 | Joback Calculated Property |
| Cp,gas | 2507.29 | J/mol×K | 1493.35 | Joback Calculated Property |
| Cp,gas | 2539.27 | J/mol×K | 1560.30 | Joback Calculated Property |
| η | [0.0000024; 0.0003438] | Pa×s | [503.10; 1158.60] |
|
| η | 0.0003438 | Pa×s | 503.10 | Joback Calculated Property |
| η | 0.0000718 | Pa×s | 612.35 | Joback Calculated Property |
| η | 0.0000241 | Pa×s | 721.60 | Joback Calculated Property |
| η | 0.0000108 | Pa×s | 830.85 | Joback Calculated Property |
| η | 0.0000058 | Pa×s | 940.10 | Joback Calculated Property |
| η | 0.0000036 | Pa×s | 1049.35 | Joback Calculated Property |
| η | 0.0000024 | Pa×s | 1158.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 13,17,21,25-Tetramethylheptatriacontane.
Sources
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