- InChI
- InChI=1S/C17H24O5/c1-11(2)13(4)21-16(18)8-9-17(19)22-15-10-12(3)6-7-14(15)20-5/h6-7,10-11,13H,8-9H2,1-5H3
- InChI Key
- FLBPKSMDNHNDLO-UHFFFAOYSA-N
- Formula
- C17H24O5
- SMILES
-
COc1ccc(C)cc1OC(=O)CCC(=O)OC(C
)C(C)C - Molecular Weight1
- 308.37
- 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° | -392.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -813.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.98 | kJ/mol | Joback Calculated Property |
| log10WS | -4.04 | Crippen Calculated Property | |
| logPoct/wat | 3.277 | Crippen Calculated Property | |
| McVol | 247.380 | ml/mol | McGowan Calculated Property |
| Pc | 1655.15 | kPa | Joback Calculated Property |
| Inp | [2162.00; 2162.00] |
|
|
| Inp | 2162.00 | NIST | |
| Inp | 2162.00 | NIST | |
| Tboil | 799.12 | K | Joback Calculated Property |
| Tc | 1005.12 | K | Joback Calculated Property |
| Tfus | 469.36 | K | Joback Calculated Property |
| Vc | 0.933 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [732.96; 807.75] | J/mol×K | [799.12; 1005.12] |
|
| Cp,gas | 732.96 | J/mol×K | 799.12 | Joback Calculated Property |
| Cp,gas | 748.24 | J/mol×K | 833.45 | Joback Calculated Property |
| Cp,gas | 762.40 | J/mol×K | 867.79 | Joback Calculated Property |
| Cp,gas | 775.44 | J/mol×K | 902.12 | Joback Calculated Property |
| Cp,gas | 787.34 | J/mol×K | 936.45 | Joback Calculated Property |
| Cp,gas | 798.11 | J/mol×K | 970.79 | Joback Calculated Property |
| Cp,gas | 807.75 | J/mol×K | 1005.12 | Joback Calculated Property |
| η | [0.0000531; 0.0006097] | Pa×s | [469.36; 799.12] |
|
| η | 0.0006097 | Pa×s | 469.36 | Joback Calculated Property |
| η | 0.0003280 | Pa×s | 524.32 | Joback Calculated Property |
| η | 0.0001985 | Pa×s | 579.28 | Joback Calculated Property |
| η | 0.0001310 | Pa×s | 634.24 | Joback Calculated Property |
| η | 0.0000924 | Pa×s | 689.20 | Joback Calculated Property |
| η | 0.0000686 | Pa×s | 744.16 | Joback Calculated Property |
| η | 0.0000531 | Pa×s | 799.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 3-methylbut-2-yl 2-methoxy-5-methylphenyl ester.
Sources
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