- InChI
- InChI=1S/C35H72O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-33-37-35-32-34-36-4-2/h3-35H2,1-2H3
- InChI Key
- TXXXKIKIOHIGPF-UHFFFAOYSA-N
- Formula
- C35H72O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
OCCCOCC - Molecular Weight1
- 524.95
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.4732 | Relay (1.0) Calculated Property | |
| ΔfG° | 33.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1018.50 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 88.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 171.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.95 | eV | Relay (1.0) Calculated Property |
| log10WS | -11.06 | Relay (1.0) Calculated Property | |
| logPoct/wat | 12.372 | Crippen Calculated Property | |
| McVol | 515.750 | ml/mol | McGowan Calculated Property |
| Pc | 470.13 | kPa | Joback Calculated Property |
| Inp | [3554.00; 3554.00] |
|
|
| Inp | 3554.00 | NIST | |
| Inp | 3554.00 | NIST | |
| Tboil | 690.93 | K | Relay (1.0) Calculated Property |
| Tc | 859.25 | K | Relay (1.0) Calculated Property |
| Tfus | 313.22 | K | Relay (1.0) Calculated Property |
| Vc | 2.033 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1895.30; 2049.94] | J/mol×K | [1045.04; 1347.40] |
|
| Cp,gas | 1895.30 | J/mol×K | 1045.04 | Joback Calculated Property |
| Cp,gas | 1929.03 | J/mol×K | 1095.43 | Joback Calculated Property |
| Cp,gas | 1959.28 | J/mol×K | 1145.83 | Joback Calculated Property |
| Cp,gas | 1986.26 | J/mol×K | 1196.22 | Joback Calculated Property |
| Cp,gas | 2010.22 | J/mol×K | 1246.61 | Joback Calculated Property |
| Cp,gas | 2031.37 | J/mol×K | 1297.01 | Joback Calculated Property |
| Cp,gas | 2049.94 | J/mol×K | 1347.40 | Joback Calculated Property |
| η | [0.0000060; 0.0002176] | Pa×s | [528.67; 1045.04] |
|
| η | 0.0002176 | Pa×s | 528.67 | Joback Calculated Property |
| η | 0.0000785 | Pa×s | 614.73 | Joback Calculated Property |
| η | 0.0000364 | Pa×s | 700.79 | Joback Calculated Property |
| η | 0.0000199 | Pa×s | 786.86 | Joback Calculated Property |
| η | 0.0000123 | Pa×s | 872.92 | Joback Calculated Property |
| η | 0.0000083 | Pa×s | 958.98 | Joback Calculated Property |
| η | 0.0000060 | Pa×s | 1045.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Propanediol, ethyl triacontyl ether.
Sources
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