- InChI
- InChI=1S/C38H68O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38(39)4-2/h10-11,17-18,24-25,31-32H,3-9,12-16,19-23,26-30,33-37H2,1-2H3/b11-10+,18-17+,25-24+,32-31+
- InChI Key
- ZUOUHKCYMKZKKW-NWFVHWQVSA-N
- Formula
- C38H68O
- SMILES
-
CCCCCCCC=CCCCCCC=CCCCCCC=CCCCC
CC=CCCCCCC(=O)CC - Molecular Weight1
- 540.95
- Other Names
-
- Octatriaconta-9E,16E,23E,30E-tetraen-3-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° | 461.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -471.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 96.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.76 | kJ/mol | Joback Calculated Property |
| log10WS | -14.42 | Crippen Calculated Property | |
| logPoct/wat | 13.353 | Crippen Calculated Property | |
| McVol | 530.650 | ml/mol | McGowan Calculated Property |
| Pc | 473.62 | kPa | Joback Calculated Property |
| Inp | [3958.00; 3958.00] |
|
|
| Inp | 3958.00 | NIST | |
| Inp | 3958.00 | NIST | |
| Inp | 3958.00 | NIST | |
| Tboil | 1139.35 | K | Joback Calculated Property |
| Tc | 1464.61 | K | Joback Calculated Property |
| Tfus | 547.63 | K | Joback Calculated Property |
| Vc | 2.090 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1951.52; 2178.59] | J/mol×K | [1139.35; 1464.61] |
|
| Cp,gas | 1951.52 | J/mol×K | 1139.35 | Joback Calculated Property |
| Cp,gas | 1989.35 | J/mol×K | 1193.56 | Joback Calculated Property |
| Cp,gas | 2026.40 | J/mol×K | 1247.77 | Joback Calculated Property |
| Cp,gas | 2063.26 | J/mol×K | 1301.98 | Joback Calculated Property |
| Cp,gas | 2100.51 | J/mol×K | 1356.19 | Joback Calculated Property |
| Cp,gas | 2138.75 | J/mol×K | 1410.40 | Joback Calculated Property |
| Cp,gas | 2178.59 | J/mol×K | 1464.61 | Joback Calculated Property |
| η | [0.0000039; 0.0001788] | Pa×s | [547.63; 1139.35] |
|
| η | 0.0001788 | Pa×s | 547.63 | Joback Calculated Property |
| η | 0.0000580 | Pa×s | 646.25 | Joback Calculated Property |
| η | 0.0000254 | Pa×s | 744.87 | Joback Calculated Property |
| η | 0.0000135 | Pa×s | 843.49 | Joback Calculated Property |
| η | 0.0000081 | Pa×s | 942.11 | Joback Calculated Property |
| η | 0.0000054 | Pa×s | 1040.73 | Joback Calculated Property |
| η | 0.0000039 | Pa×s | 1139.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9E,16E,23E,30E-octatriaconta-tetraen-3-one.
Sources
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