- InChI
- InChI=1S/C22H30O2/c1-3-4-5-6-7-8-12-18(2)24-22(23)17-20-15-11-14-19-13-9-10-16-21(19)20/h9-11,13-16,18H,3-8,12,17H2,1-2H3
- InChI Key
- DYGPXJXWLAPOJP-UHFFFAOYSA-N
- Formula
- C22H30O2
- SMILES
-
CCCCCCCCC(C)OC(=O)Cc1cccc2cccc
c12 - Molecular Weight1
- 326.47
- 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 | 0.8682 | Relay (1.0) Calculated Property | |
| ΔfG° | 107.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -442.71 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 42.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.14 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.04 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.03 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.065 | Crippen Calculated Property | |
| McVol | 285.060 | ml/mol | McGowan Calculated Property |
| Pc | 1356.63 | kPa | Joback Calculated Property |
| Inp | [1340.00; 1340.00] |
|
|
| Inp | 1340.00 | NIST | |
| Inp | 1340.00 | NIST | |
| Tboil | 661.37 | K | Relay (1.0) Calculated Property |
| Tc | 897.70 | K | Relay (1.0) Calculated Property |
| Tfus | 311.29 | K | Relay (1.0) Calculated Property |
| Vc | 1.058 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [874.56; 963.56] | J/mol×K | [829.25; 1037.23] |
|
| Cp,gas | 874.56 | J/mol×K | 829.25 | Joback Calculated Property |
| Cp,gas | 891.89 | J/mol×K | 863.91 | Joback Calculated Property |
| Cp,gas | 908.13 | J/mol×K | 898.58 | Joback Calculated Property |
| Cp,gas | 923.35 | J/mol×K | 933.24 | Joback Calculated Property |
| Cp,gas | 937.62 | J/mol×K | 967.90 | Joback Calculated Property |
| Cp,gas | 951.00 | J/mol×K | 1002.56 | Joback Calculated Property |
| Cp,gas | 963.56 | J/mol×K | 1037.23 | Joback Calculated Property |
| η | [0.0001022; 0.0010383] | Pa×s | [466.50; 829.25] |
|
| η | 0.0010383 | Pa×s | 466.50 | Joback Calculated Property |
| η | 0.0005652 | Pa×s | 526.96 | Joback Calculated Property |
| η | 0.0003487 | Pa×s | 587.42 | Joback Calculated Property |
| η | 0.0002354 | Pa×s | 647.88 | Joback Calculated Property |
| η | 0.0001700 | Pa×s | 708.33 | Joback Calculated Property |
| η | 0.0001292 | Pa×s | 768.79 | Joback Calculated Property |
| η | 0.0001022 | Pa×s | 829.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Naphthaleneacetic acid, dec-2-yl ester.
Sources
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