- InChI
- InChI=1S/C82H166/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-71-73-75-77-79-81-82-80-78-76-74-72-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-82H2,1-2H3
- InChI Key
- UXMDGVPNICZCNN-UHFFFAOYSA-N
- Formula
- C82H166
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCCCCC - Molecular Weight1
- 1152.20
- CAS
- 7719-95-1
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Tboil : Normal Boiling Point 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° | 639.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1735.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 208.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 387.20 ± 3.80 | kJ/mol | NIST |
| log10WS | -34.15 | Crippen Calculated Property | |
| logPoct/wat | 32.234 | Crippen Calculated Property | |
| McVol | 1166.240 | ml/mol | McGowan Calculated Property |
| Pc | 121.02 | kPa | Joback Calculated Property |
| Tboil | 2075.56 | K | Joback Calculated Property |
| Tfus | 383.50 ± 0.30 | K | NIST |
| Vc | 4.628 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [3158.41; 5615.44] | J/mol×K | [583.89; 2075.56] | 
|
| Cp,gas | 3158.41 | J/mol×K | 583.89 | Joback Calculated Property |
| Cp,gas | 5615.44 | J/mol×K | 2075.56 | Joback Calculated Property |
| η | [2.9514817e-09; 0.0000002] | Pa×s | [1013.90; 2075.56] |
|
| η | 0.0000002 | Pa×s | 1013.90 | Joback Calculated Property |
| η | 5.2308074e-08 | Pa×s | 1190.84 | Joback Calculated Property |
| η | 2.1860020e-08 | Pa×s | 1367.79 | Joback Calculated Property |
| η | 1.1156805e-08 | Pa×s | 1544.73 | Joback Calculated Property |
| η | 6.5384068e-09 | Pa×s | 1721.67 | Joback Calculated Property |
| η | 4.2331104e-09 | Pa×s | 1898.62 | Joback Calculated Property |
| η | 2.9514817e-09 | Pa×s | 2075.56 | Joback Calculated Property |
| ΔvapH | 185.30 | kJ/mol | 824.00 | NIST |
Similar Compounds
Find more compounds similar to dooctacontane.
Sources
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