- InChI
- InChI=1S/C16H30O4/c1-3-5-7-9-11-13-19-15(17)16(18)20-14-12-10-8-6-4-2/h3-14H2,1-2H3
- InChI Key
- BODADHIQAXIHKU-UHFFFAOYSA-N
- Formula
- C16H30O4
- SMILES
- CCCCCCCOC(=O)C(=O)OCCCCCCC
- Molecular Weight1
- 286.41
- CAS
- 20442-03-9
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.9557 | Relay (1.0) Calculated Property | |
| ΔfG° | -536.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -922.57 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.48 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.67 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.02 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.014 | Crippen Calculated Property | |
| McVol | 251.180 | ml/mol | McGowan Calculated Property |
| Pc | 1328.10 | kPa | Joback Calculated Property |
| Tboil | 584.02 | K | Relay (1.0) Calculated Property |
| Tc | 744.51 | K | Relay (1.0) Calculated Property |
| Tfus | 262.64 | K | Relay (1.0) Calculated Property |
| Vc | 0.985 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [718.59; 807.57] | J/mol×K | [682.12; 853.11] | 
|
| Cp,gas | 718.59 | J/mol×K | 682.12 | Joback Calculated Property |
| Cp,gas | 735.50 | J/mol×K | 710.62 | Joback Calculated Property |
| Cp,gas | 751.56 | J/mol×K | 739.12 | Joback Calculated Property |
| Cp,gas | 766.79 | J/mol×K | 767.62 | Joback Calculated Property |
| Cp,gas | 781.20 | J/mol×K | 796.11 | Joback Calculated Property |
| Cp,gas | 794.79 | J/mol×K | 824.61 | Joback Calculated Property |
| Cp,gas | 807.57 | J/mol×K | 853.11 | Joback Calculated Property |
| η | [0.0000751; 0.0025205] | Pa×s | [354.74; 682.12] |
|
| η | 0.0025205 | Pa×s | 354.74 | Joback Calculated Property |
| η | 0.0009500 | Pa×s | 409.30 | Joback Calculated Property |
| η | 0.0004505 | Pa×s | 463.87 | Joback Calculated Property |
| η | 0.0002499 | Pa×s | 518.43 | Joback Calculated Property |
| η | 0.0001551 | Pa×s | 572.99 | Joback Calculated Property |
| η | 0.0001046 | Pa×s | 627.56 | Joback Calculated Property |
| η | 0.0000751 | Pa×s | 682.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to diheptyl oxalate.
Sources
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