- InChI
- InChI=1S/C10H18O3/c1-13-10(12)8-6-4-2-3-5-7-9-11/h9H,2-8H2,1H3
- InChI Key
- JMLYDLZRFNYHHO-UHFFFAOYSA-N
- Formula
- C10H18O3
- SMILES
- COC(=O)CCCCCCCC=O
- Molecular Weight1
- 186.25
- CAS
- 1931-63-1
- Other Names
-
- Azelaaldehydic acid, methyl ester
- Methyl azelaaldehydate
- Methyl 8-formyloctanoate
- Methyl 9-oxononanoate
- 9-Oxononanoic acid methyl ester
- 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° | -300.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -580.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.73 | kJ/mol | Joback Calculated Property |
| log10WS | -2.15 | Crippen Calculated Property | |
| logPoct/wat | 2.089 | Crippen Calculated Property | |
| McVol | 160.770 | ml/mol | McGowan Calculated Property |
| Pc | 2361.07 | kPa | Joback Calculated Property |
| Inp | [1436.00; 1439.00] |
|
|
| Inp | 1439.00 | NIST | |
| Inp | 1436.00 | NIST | |
| Inp | 1436.00 | NIST | |
| Tboil | 553.15 | K | Joback Calculated Property |
| Tc | 730.17 | K | Joback Calculated Property |
| Tfus | 316.62 | K | Joback Calculated Property |
| Vc | 0.636 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [390.85; 461.13] | J/mol×K | [553.15; 730.17] |
|
| Cp,gas | 390.85 | J/mol×K | 553.15 | Joback Calculated Property |
| Cp,gas | 403.90 | J/mol×K | 582.65 | Joback Calculated Property |
| Cp,gas | 416.40 | J/mol×K | 612.16 | Joback Calculated Property |
| Cp,gas | 428.36 | J/mol×K | 641.66 | Joback Calculated Property |
| Cp,gas | 439.81 | J/mol×K | 671.16 | Joback Calculated Property |
| Cp,gas | 450.73 | J/mol×K | 700.67 | Joback Calculated Property |
| Cp,gas | 461.13 | J/mol×K | 730.17 | Joback Calculated Property |
| η | [0.0002591; 0.0029976] | Pa×s | [316.62; 553.15] |
|
| η | 0.0029976 | Pa×s | 316.62 | Joback Calculated Property |
| η | 0.0015901 | Pa×s | 356.04 | Joback Calculated Property |
| η | 0.0009572 | Pa×s | 395.46 | Joback Calculated Property |
| η | 0.0006317 | Pa×s | 434.88 | Joback Calculated Property |
| η | 0.0004467 | Pa×s | 474.31 | Joback Calculated Property |
| η | 0.0003332 | Pa×s | 513.73 | Joback Calculated Property |
| η | 0.0002591 | Pa×s | 553.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Nonanoic acid, 9-oxo-, methyl ester.
Sources
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