- InChI
- InChI=1S/C39H76O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37,40H,3-36H2,1-2H3
- InChI Key
- UHUSDOQQWJGJQS-UHFFFAOYSA-N
- Formula
- C39H76O5
- SMILES
-
CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O
C(=O)CCCCCCCCCCCCCCCCC - Molecular Weight1
- 625.02
- CAS
- 51063-97-9
- Other Names
-
- (±)-1-(hydroxymethyl)ethane-1,2-diyl distearate
- 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).
- 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° | -329.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1495.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 102.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 137.01 | kJ/mol | Joback Calculated Property |
| log10WS | -13.25 | Crippen Calculated Property | |
| logPoct/wat | 11.957 | Crippen Calculated Property | |
| McVol | 581.120 | ml/mol | McGowan Calculated Property |
| Pc | 439.50 | kPa | Joback Calculated Property |
| Tboil | 1336.04 | K | Joback Calculated Property |
| Tc | 2006.21 | K | Joback Calculated Property |
| Tfus | 719.43 | K | Joback Calculated Property |
| Vc | 2.280 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [2257.79; 2358.18] | J/mol×K | [1336.04; 2006.21] | 
|
| Cp,gas | 2257.79 | J/mol×K | 1336.04 | Joback Calculated Property |
| Cp,gas | 2291.34 | J/mol×K | 1447.74 | Joback Calculated Property |
| Cp,gas | 2314.44 | J/mol×K | 1559.43 | Joback Calculated Property |
| Cp,gas | 2329.87 | J/mol×K | 1671.13 | Joback Calculated Property |
| Cp,gas | 2340.44 | J/mol×K | 1782.82 | Joback Calculated Property |
| Cp,gas | 2348.95 | J/mol×K | 1894.52 | Joback Calculated Property |
| Cp,gas | 2358.18 | J/mol×K | 2006.21 | Joback Calculated Property |
| η | [0.0000002; 0.0000123] | Pa×s | [719.43; 1336.04] |
|
| η | 0.0000123 | Pa×s | 719.43 | Joback Calculated Property |
| η | 0.0000040 | Pa×s | 822.20 | Joback Calculated Property |
| η | 0.0000017 | Pa×s | 924.97 | Joback Calculated Property |
| η | 0.0000008 | Pa×s | 1027.74 | Joback Calculated Property |
| η | 0.0000005 | Pa×s | 1130.50 | Joback Calculated Property |
| η | 0.0000003 | Pa×s | 1233.27 | Joback Calculated Property |
| η | 0.0000002 | Pa×s | 1336.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Distearin.
Sources
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