- InChI
- InChI=1S/C29H60O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27-31-29-26-28-30-4-2/h3-29H2,1-2H3
- InChI Key
- DPJMBSVCDUJOCA-UHFFFAOYSA-N
- Formula
- C29H60O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCOCCCOC
C - Molecular Weight1
- 440.79
- 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 | 1.2630 | Relay (1.0) Calculated Property | |
| ΔfG° | -16.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -895.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 73.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 145.10 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 10.032 | Crippen Calculated Property | |
| McVol | 431.210 | ml/mol | McGowan Calculated Property |
| Pc | 613.90 | kPa | Joback Calculated Property |
| Inp | [2970.00; 2970.00] |
|
|
| Inp | 2970.00 | NIST | |
| Inp | 2970.00 | NIST | |
| Tboil | 653.79 | K | Relay (1.0) Calculated Property |
| Tc | 828.32 | K | Relay (1.0) Calculated Property |
| Tfus | 297.90 | K | Relay (1.0) Calculated Property |
| Vc | 1.707 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1487.64; 1621.67] | J/mol×K | [907.96; 1122.63] |
|
| Cp,gas | 1487.64 | J/mol×K | 907.96 | Joback Calculated Property |
| Cp,gas | 1514.24 | J/mol×K | 943.74 | Joback Calculated Property |
| Cp,gas | 1539.04 | J/mol×K | 979.52 | Joback Calculated Property |
| Cp,gas | 1562.13 | J/mol×K | 1015.30 | Joback Calculated Property |
| Cp,gas | 1583.55 | J/mol×K | 1051.07 | Joback Calculated Property |
| Cp,gas | 1603.38 | J/mol×K | 1086.85 | Joback Calculated Property |
| Cp,gas | 1621.67 | J/mol×K | 1122.63 | Joback Calculated Property |
| η | [0.0000154; 0.0005153] | Pa×s | [461.05; 907.96] |
|
| η | 0.0005153 | Pa×s | 461.05 | Joback Calculated Property |
| η | 0.0001913 | Pa×s | 535.53 | Joback Calculated Property |
| η | 0.0000904 | Pa×s | 610.02 | Joback Calculated Property |
| η | 0.0000503 | Pa×s | 684.50 | Joback Calculated Property |
| η | 0.0000314 | Pa×s | 758.99 | Joback Calculated Property |
| η | 0.0000213 | Pa×s | 833.48 | Joback Calculated Property |
| η | 0.0000154 | Pa×s | 907.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Propanediol, ethyl tetracosyl ether.
Sources
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