- InChI
- InChI=1S/C13H18O10/c1-5(14)20-8-9(21-6(2)15)11(22-7(3)16)13(19-4)23-10(8)12(17)18/h8-11,13H,1-4H3,(H,17,18)
- InChI Key
- YAYYBTSPWBBXRC-UHFFFAOYSA-N
- Formula
- C13H18O10
- SMILES
-
COC1OC(C(=O)O)C(OC(C)=O)C(OC(C
)=O)C1OC(C)=O - Molecular Weight1
- 334.28
- 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° | -1106.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1602.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.54 | kJ/mol | Joback Calculated Property |
| log10WS | -0.07 | Crippen Calculated Property | |
| logPoct/wat | -0.763 | Crippen Calculated Property | |
| McVol | 224.670 | ml/mol | McGowan Calculated Property |
| Pc | 2212.45 | kPa | Joback Calculated Property |
| Inp | [1726.00; 1726.00] |
|
|
| Inp | 1726.00 | NIST | |
| Inp | 1726.00 | NIST | |
| Tboil | 922.00 | K | Joback Calculated Property |
| Tc | 1134.12 | K | Joback Calculated Property |
| Tfus | 602.72 | K | Joback Calculated Property |
| Vc | 0.829 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [750.47; 783.80] | J/mol×K | [922.00; 1134.12] |
|
| Cp,gas | 750.47 | J/mol×K | 922.00 | Joback Calculated Property |
| Cp,gas | 760.31 | J/mol×K | 957.35 | Joback Calculated Property |
| Cp,gas | 768.51 | J/mol×K | 992.71 | Joback Calculated Property |
| Cp,gas | 775.01 | J/mol×K | 1028.06 | Joback Calculated Property |
| Cp,gas | 779.77 | J/mol×K | 1063.42 | Joback Calculated Property |
| Cp,gas | 782.71 | J/mol×K | 1098.77 | Joback Calculated Property |
| Cp,gas | 783.80 | J/mol×K | 1134.12 | Joback Calculated Property |
| η | [0.0000267; 0.0002793] | Pa×s | [602.72; 922.00] |
|
| η | 0.0002793 | Pa×s | 602.72 | Joback Calculated Property |
| η | 0.0001611 | Pa×s | 655.93 | Joback Calculated Property |
| η | 0.0001009 | Pa×s | 709.15 | Joback Calculated Property |
| η | 0.0000675 | Pa×s | 762.36 | Joback Calculated Property |
| η | 0.0000476 | Pa×s | 815.57 | Joback Calculated Property |
| η | 0.0000350 | Pa×s | 868.79 | Joback Calculated Property |
| η | 0.0000267 | Pa×s | 922.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methyl glucuronide, acetate.
Sources
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