- InChI
- InChI=1S/C27H50O16/c1-28-12-13-14(29-2)15(30-3)18(31-4)26(39-13)40-17-21(34-7)25(38-11)43-27(22(17)35-8)41-16-19(32-5)23(36-9)42-24(37-10)20(16)33-6/h13-27H,12H2,1-11H3/t13-,14-,15+,16-,17+,18-,19-,20+,21+,22-,23?,24+,25+,26+,27-/m1/s1
- InChI Key
- GIDNCUSCVDMDSU-OBPAOPMPSA-N
- Formula
- C27H50O16
- SMILES
-
COCC1OC(OC2C(OC)C(OC)OC(OC3C(O
C)C(OC)OC(OC)C3OC)C2OC)C(OC)C( OC)C1OC - Molecular Weight1
- 630.68
- 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° | -1466.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2796.59 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 93.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 118.14 | kJ/mol | Joback Calculated Property |
| log10WS | -0.36 | Crippen Calculated Property | |
| logPoct/wat | -0.463 | Crippen Calculated Property | |
| McVol | 452.630 | ml/mol | McGowan Calculated Property |
| Pc | 678.52 | kPa | Joback Calculated Property |
| Inp | [3171.00; 3171.00] |
|
|
| Inp | 3171.00 | NIST | |
| Inp | 3171.00 | NIST | |
| Tboil | 1192.08 | K | Joback Calculated Property |
| Tc | 1486.66 | K | Joback Calculated Property |
| Tfus | 734.01 | K | Joback Calculated Property |
| Vc | 1.631 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1487.60; 1771.81] | J/mol×K | [1192.08; 1486.66] |
|
| Cp,gas | 1771.81 | J/mol×K | 1192.08 | Joback Calculated Property |
| Cp,gas | 1753.75 | J/mol×K | 1241.18 | Joback Calculated Property |
| Cp,gas | 1724.66 | J/mol×K | 1290.27 | Joback Calculated Property |
| Cp,gas | 1684.03 | J/mol×K | 1339.37 | Joback Calculated Property |
| Cp,gas | 1631.32 | J/mol×K | 1388.47 | Joback Calculated Property |
| Cp,gas | 1566.02 | J/mol×K | 1437.57 | Joback Calculated Property |
| Cp,gas | 1487.60 | J/mol×K | 1486.66 | Joback Calculated Property |
| η | [0.0000192; 0.0000719] | Pa×s | [734.01; 1192.08] |
|
| η | 0.0000719 | Pa×s | 734.01 | Joback Calculated Property |
| η | 0.0000520 | Pa×s | 810.36 | Joback Calculated Property |
| η | 0.0000398 | Pa×s | 886.70 | Joback Calculated Property |
| η | 0.0000318 | Pa×s | 963.04 | Joback Calculated Property |
| η | 0.0000262 | Pa×s | 1039.39 | Joback Calculated Property |
| η | 0.0000222 | Pa×s | 1115.73 | Joback Calculated Property |
| η | 0.0000192 | Pa×s | 1192.08 | Joback Calculated Property |
Similar Compounds
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Sources
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