- InChI
- InChI=1S/C9H16O3/c10-8-6-4-2-1-3-5-7-9(11)12/h8H,1-7H2,(H,11,12)
- InChI Key
- WLGDDELKYAWBBL-UHFFFAOYSA-N
- Formula
- C9H16O3
- SMILES
- O=CCCCCCCCC(=O)O
- Molecular Weight1
- 172.22
- CAS
- 2553-17-5
- 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).
- 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 |
|---|---|---|---|
| ω | 0.8365 | Relay (1.0) Calculated Property | |
| ΔfG° | -340.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -661.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.26 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.70 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.001 | Crippen Calculated Property | |
| McVol | 146.680 | ml/mol | McGowan Calculated Property |
| Pc | 2912.39 | kPa | Joback Calculated Property |
| Inp | [1483.00; 1483.00] |
|
|
| Inp | 1483.00 | NIST | |
| Inp | 1483.00 | NIST | |
| Tboil | 557.33 | K | Relay (1.0) Calculated Property |
| Tc | 757.71 | K | Relay (1.0) Calculated Property |
| Tfus | 346.75 | K | Relay (1.0) Calculated Property |
| Vc | 0.544 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [373.39; 429.94] | J/mol×K | [600.03; 772.51] |
|
| Cp,gas | 373.39 | J/mol×K | 600.03 | Joback Calculated Property |
| Cp,gas | 383.98 | J/mol×K | 628.78 | Joback Calculated Property |
| Cp,gas | 394.08 | J/mol×K | 657.52 | Joback Calculated Property |
| Cp,gas | 403.72 | J/mol×K | 686.27 | Joback Calculated Property |
| Cp,gas | 412.89 | J/mol×K | 715.02 | Joback Calculated Property |
| Cp,gas | 421.63 | J/mol×K | 743.76 | Joback Calculated Property |
| Cp,gas | 429.94 | J/mol×K | 772.51 | Joback Calculated Property |
| η | [0.0001187; 0.0072689] | Pa×s | [343.94; 600.03] |
|
| η | 0.0072689 | Pa×s | 343.94 | Joback Calculated Property |
| η | 0.0025072 | Pa×s | 386.62 | Joback Calculated Property |
| η | 0.0010686 | Pa×s | 429.30 | Joback Calculated Property |
| η | 0.0005314 | Pa×s | 471.99 | Joback Calculated Property |
| η | 0.0002967 | Pa×s | 514.67 | Joback Calculated Property |
| η | 0.0001812 | Pa×s | 557.35 | Joback Calculated Property |
| η | 0.0001187 | Pa×s | 600.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9-Oxononanoic acid.
Sources
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