- InChI
- InChI=1S/C12H18O7/c1-6-11(18-8(3)14)12(19-9(4)15)10(5-16-6)17-7(2)13/h6,10-12H,5H2,1-4H3/t6-,10+,11+,12+/m1/s1
- InChI Key
- QPTFIDGGNPUDEM-VYLNZQIESA-N
- Formula
- C12H18O7
- SMILES
-
CC(=O)OC1COC(C)C(OC(C)=O)C1OC(
C)=O - Molecular Weight1
- 274.27
- 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° | -736.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1164.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.79 | kJ/mol | Joback Calculated Property |
| log10WS | -0.86 | Crippen Calculated Property | |
| logPoct/wat | 0.200 | Crippen Calculated Property | |
| McVol | 197.270 | ml/mol | McGowan Calculated Property |
| Pc | 2193.84 | kPa | Joback Calculated Property |
| Inp | [1588.91; 1588.91] |
|
|
| Inp | 1588.91 | NIST | |
| Inp | 1588.91 | NIST | |
| Tboil | 735.32 | K | Joback Calculated Property |
| Tc | 943.30 | K | Joback Calculated Property |
| Tfus | 462.71 | K | Joback Calculated Property |
| Vc | 0.731 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [595.91; 672.54] | J/mol×K | [735.32; 943.30] |
|
| Cp,gas | 595.91 | J/mol×K | 735.32 | Joback Calculated Property |
| Cp,gas | 611.64 | J/mol×K | 769.98 | Joback Calculated Property |
| Cp,gas | 626.24 | J/mol×K | 804.65 | Joback Calculated Property |
| Cp,gas | 639.66 | J/mol×K | 839.31 | Joback Calculated Property |
| Cp,gas | 651.88 | J/mol×K | 873.97 | Joback Calculated Property |
| Cp,gas | 662.85 | J/mol×K | 908.64 | Joback Calculated Property |
| Cp,gas | 672.54 | J/mol×K | 943.30 | Joback Calculated Property |
| η | [0.0002054; 0.0011531] | Pa×s | [462.71; 735.32] |
|
| η | 0.0011531 | Pa×s | 462.71 | Joback Calculated Property |
| η | 0.0007606 | Pa×s | 508.15 | Joback Calculated Property |
| η | 0.0005372 | Pa×s | 553.58 | Joback Calculated Property |
| η | 0.0003999 | Pa×s | 599.01 | Joback Calculated Property |
| η | 0.0003104 | Pa×s | 644.45 | Joback Calculated Property |
| η | 0.0002491 | Pa×s | 689.88 | Joback Calculated Property |
| η | 0.0002054 | Pa×s | 735.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,4-tri-O-acetyl-1,5-anhydro-D-fucitol.
Sources
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