- InChI
- InChI=1S/C39H74O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39(2)40/h18-19,25-26H,3-17,20-24,27-38H2,1-2H3/b19-18+,26-25+
- InChI Key
- MHNHPKZTUVMCRT-NJGOVPIFSA-N
- Formula
- C39H74O
- SMILES
-
CCCCCCCCCCCCCCCCC=CCCCCCC=CCCC
CCCCCCCCCC(C)=O - Molecular Weight1
- 559.00
- Other Names
-
- Nonatriaconta-15E,22E-dien-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° | 309.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -726.43 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 98.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.07 | kJ/mol | Joback Calculated Property |
| log10WS | -15.14 | Crippen Calculated Property | |
| logPoct/wat | 14.191 | Crippen Calculated Property | |
| McVol | 553.340 | ml/mol | McGowan Calculated Property |
| Pc | 434.93 | kPa | Joback Calculated Property |
| Inp | [4087.00; 4087.00] |
|
|
| Inp | 4087.00 | NIST | |
| Inp | 4087.00 | NIST | |
| Inp | 4087.00 | NIST | |
| Tboil | 1153.91 | K | Joback Calculated Property |
| Tc | 1519.99 | K | Joback Calculated Property |
| Tfus | 569.06 | K | Joback Calculated Property |
| Vc | 2.186 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [2076.07; 2302.99] | J/mol×K | [1153.91; 1519.99] |
|
| Cp,gas | 2076.07 | J/mol×K | 1153.91 | Joback Calculated Property |
| Cp,gas | 2116.72 | J/mol×K | 1214.92 | Joback Calculated Property |
| Cp,gas | 2155.26 | J/mol×K | 1275.94 | Joback Calculated Property |
| Cp,gas | 2192.42 | J/mol×K | 1336.95 | Joback Calculated Property |
| Cp,gas | 2228.94 | J/mol×K | 1397.96 | Joback Calculated Property |
| Cp,gas | 2265.55 | J/mol×K | 1458.97 | Joback Calculated Property |
| Cp,gas | 2302.99 | J/mol×K | 1519.99 | Joback Calculated Property |
| η | [0.0000042; 0.0001748] | Pa×s | [569.06; 1153.91] |
|
| η | 0.0001748 | Pa×s | 569.06 | Joback Calculated Property |
| η | 0.0000597 | Pa×s | 666.53 | Joback Calculated Property |
| η | 0.0000268 | Pa×s | 764.01 | Joback Calculated Property |
| η | 0.0000144 | Pa×s | 861.48 | Joback Calculated Property |
| η | 0.0000088 | Pa×s | 958.96 | Joback Calculated Property |
| η | 0.0000059 | Pa×s | 1056.43 | Joback Calculated Property |
| η | 0.0000042 | Pa×s | 1153.91 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 15E,22E-nonatriaconta-dien-2-one.
Sources
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