- InChI
- InChI=1S/C21H32O5/c1-3-4-15-25-20(22)11-8-12-21(23)26-17-14-19(13-16-24-2)18-9-6-5-7-10-18/h5-7,9-10,19H,3-4,8,11-17H2,1-2H3
- InChI Key
- TWKGJBJUEOCOFQ-UHFFFAOYSA-N
- Formula
- C21H32O5
- SMILES
-
CCCCOC(=O)CCCC(=O)OCCC(CCOC)c1
ccccc1 - Molecular Weight1
- 364.48
- 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° | -336.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -867.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.95 | kJ/mol | Joback Calculated Property |
| log10WS | -4.49 | Crippen Calculated Property | |
| logPoct/wat | 4.254 | Crippen Calculated Property | |
| McVol | 303.740 | ml/mol | McGowan Calculated Property |
| Pc | 1257.48 | kPa | Joback Calculated Property |
| Inp | 2608.00 | NIST | |
| Tboil | 881.12 | K | Joback Calculated Property |
| Tc | 1084.74 | K | Joback Calculated Property |
| Tfus | 504.40 | K | Joback Calculated Property |
| Vc | 1.163 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [967.89; 1044.86] | J/mol×K | [881.12; 1084.74] | 
|
| Cp,gas | 967.89 | J/mol×K | 881.12 | Joback Calculated Property |
| Cp,gas | 983.88 | J/mol×K | 915.06 | Joback Calculated Property |
| Cp,gas | 998.58 | J/mol×K | 948.99 | Joback Calculated Property |
| Cp,gas | 1012.01 | J/mol×K | 982.93 | Joback Calculated Property |
| Cp,gas | 1024.19 | J/mol×K | 1016.86 | Joback Calculated Property |
| Cp,gas | 1035.13 | J/mol×K | 1050.80 | Joback Calculated Property |
| Cp,gas | 1044.86 | J/mol×K | 1084.74 | Joback Calculated Property |
| η | [0.0000320; 0.0004899] | Pa×s | [504.40; 881.12] |
|
| η | 0.0004899 | Pa×s | 504.40 | Joback Calculated Property |
| η | 0.0002418 | Pa×s | 567.19 | Joback Calculated Property |
| η | 0.0001374 | Pa×s | 629.97 | Joback Calculated Property |
| η | 0.0000865 | Pa×s | 692.76 | Joback Calculated Property |
| η | 0.0000588 | Pa×s | 755.55 | Joback Calculated Property |
| η | 0.0000424 | Pa×s | 818.33 | Joback Calculated Property |
| η | 0.0000320 | Pa×s | 881.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, butyl 5-methoxy-3-phenylpentyl ester.
Sources
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