- InChI
- InChI=1S/C37H66O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37(2)38/h9-10,16-17,23-24,30-31H,3-8,11-15,18-22,25-29,32-36H2,1-2H3/b10-9+,17-16+,24-23+,31-30+
- InChI Key
- DPRXWDBEWOXTBA-UGGLBSCLSA-N
- Formula
- C37H66O
- SMILES
-
CCCCCCCC=CCCCCCC=CCCCCCC=CCCCC
CC=CCCCCCC(C)=O - Molecular Weight1
- 526.92
- Other Names
-
- Heptatriaconta-8E,15E,22E,29E-tetraen-2-one
- 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° | 452.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -450.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 93.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.53 | kJ/mol | Joback Calculated Property |
| log10WS | -14.01 | Crippen Calculated Property | |
| logPoct/wat | 12.963 | Crippen Calculated Property | |
| McVol | 516.560 | ml/mol | McGowan Calculated Property |
| Pc | 494.05 | kPa | Joback Calculated Property |
| Inp | [3866.00; 3866.00] |
|
|
| Inp | 3866.00 | NIST | |
| Inp | 3866.00 | NIST | |
| Tboil | 1116.47 | K | Joback Calculated Property |
| Tc | 1422.23 | K | Joback Calculated Property |
| Tfus | 536.36 | K | Joback Calculated Property |
| Vc | 2.034 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1881.26; 2088.89] | J/mol×K | [1116.47; 1422.23] |
|
| Cp,gas | 1881.26 | J/mol×K | 1116.47 | Joback Calculated Property |
| Cp,gas | 1916.46 | J/mol×K | 1167.43 | Joback Calculated Property |
| Cp,gas | 1950.78 | J/mol×K | 1218.39 | Joback Calculated Property |
| Cp,gas | 1984.70 | J/mol×K | 1269.35 | Joback Calculated Property |
| Cp,gas | 2018.70 | J/mol×K | 1320.31 | Joback Calculated Property |
| Cp,gas | 2053.27 | J/mol×K | 1371.27 | Joback Calculated Property |
| Cp,gas | 2088.89 | J/mol×K | 1422.23 | Joback Calculated Property |
| η | [0.0000046; 0.0002082] | Pa×s | [536.36; 1116.47] |
|
| η | 0.0002082 | Pa×s | 536.36 | Joback Calculated Property |
| η | 0.0000677 | Pa×s | 633.05 | Joback Calculated Property |
| η | 0.0000296 | Pa×s | 729.73 | Joback Calculated Property |
| η | 0.0000157 | Pa×s | 826.41 | Joback Calculated Property |
| η | 0.0000096 | Pa×s | 923.10 | Joback Calculated Property |
| η | 0.0000064 | Pa×s | 1019.79 | Joback Calculated Property |
| η | 0.0000046 | Pa×s | 1116.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 8E,15E,22E,29E-heptatriaconta-tetraen-2-one.
Sources
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