- InChI
- InChI=1S/C37H68O21/c1-39-16-19-23(43-5)29(47-9)34(51-13)57-33(19)55-26(21(42-4)17-40-2)25(56-36-31(49-11)27(45-7)24(44-6)22(54-36)18-41-3)20(15-38)53-37-32(50-12)28(46-8)30(48-10)35(52-14)58-37/h15,19-37H,16-18H2,1-14H3/t19-,20?,21-,22-,23+,24+,25-,26-,27+,28+,29+,30-,31-,32-,33-,34+,35+,36-,37+/m1/s1
- InChI Key
- IHGBCBCBAWXHHN-QUOYLCKYSA-N
- Formula
- C37H68O21
- SMILES
-
COCC(OC)C(OC1OC(OC)C(OC)C(OC)C
1COC)C(OC1OC(COC)C(OC)C(OC)C1O C)C(C=O)OC1OC(OC)C(OC)C(OC)C1O C - Molecular Weight1
- 848.92
- 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° | -1911.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -3638.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 112.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 155.20 | kJ/mol | Joback Calculated Property |
| log10WS | -0.27 | Crippen Calculated Property | |
| logPoct/wat | -0.586 | Crippen Calculated Property | |
| McVol | 618.580 | ml/mol | McGowan Calculated Property |
| Pc | 441.17 | kPa | Joback Calculated Property |
| Inp | 4017.00 | NIST | |
| Tboil | 1557.46 | K | Joback Calculated Property |
| Tc | 2298.49 | K | Joback Calculated Property |
| Tfus | 917.63 | K | Joback Calculated Property |
| Vc | 2.256 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [-2309.99; 1880.27] | J/mol×K | [1557.46; 2298.49] | 
|
| Cp,gas | 1880.27 | J/mol×K | 1557.46 | Joback Calculated Property |
| Cp,gas | 1510.45 | J/mol×K | 1680.96 | Joback Calculated Property |
| Cp,gas | 1021.91 | J/mol×K | 1804.47 | Joback Calculated Property |
| Cp,gas | 405.11 | J/mol×K | 1927.97 | Joback Calculated Property |
| Cp,gas | -349.46 | J/mol×K | 2051.48 | Joback Calculated Property |
| Cp,gas | -1251.32 | J/mol×K | 2174.98 | Joback Calculated Property |
| Cp,gas | -2309.99 | J/mol×K | 2298.49 | Joback Calculated Property |
| η | [0.0000008; 0.0000058] | Pa×s | [917.63; 1557.46] |
|
| η | 0.0000058 | Pa×s | 917.63 | Joback Calculated Property |
| η | 0.0000035 | Pa×s | 1024.27 | Joback Calculated Property |
| η | 0.0000024 | Pa×s | 1130.91 | Joback Calculated Property |
| η | 0.0000017 | Pa×s | 1237.55 | Joback Calculated Property |
| η | 0.0000013 | Pa×s | 1344.18 | Joback Calculated Property |
| η | 0.0000010 | Pa×s | 1450.82 | Joback Calculated Property |
| η | 0.0000008 | Pa×s | 1557.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isomaltotetraose, permethyl.
Sources
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