- InChI
- InChI=1S/C19H24O2/c1-3-4-5-9-15(2)21-19(20)14-17-12-8-11-16-10-6-7-13-18(16)17/h6-8,10-13,15H,3-5,9,14H2,1-2H3
- InChI Key
- WHRWQXSIZHRSRB-UHFFFAOYSA-N
- Formula
- C19H24O2
- SMILES
- CCCCCC(C)OC(=O)Cc1cccc2ccccc12
- Molecular Weight1
- 284.39
- 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 | 0.7424 | Relay (1.0) Calculated Property | |
| ΔfG° | 82.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -380.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.79 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.97 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.96 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.894 | Crippen Calculated Property | |
| McVol | 242.790 | ml/mol | McGowan Calculated Property |
| Pc | 1697.70 | kPa | Joback Calculated Property |
| Inp | 2740.00 | NIST | |
| Tboil | 636.22 | K | Relay (1.0) Calculated Property |
| Tc | 874.09 | K | Relay (1.0) Calculated Property |
| Tfus | 302.97 | K | Relay (1.0) Calculated Property |
| Vc | 0.893 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [701.43; 786.83] | J/mol×K | [760.61; 973.46] | 
|
| Cp,gas | 701.43 | J/mol×K | 760.61 | Joback Calculated Property |
| Cp,gas | 718.16 | J/mol×K | 796.08 | Joback Calculated Property |
| Cp,gas | 733.81 | J/mol×K | 831.56 | Joback Calculated Property |
| Cp,gas | 748.44 | J/mol×K | 867.03 | Joback Calculated Property |
| Cp,gas | 762.11 | J/mol×K | 902.51 | Joback Calculated Property |
| Cp,gas | 774.89 | J/mol×K | 937.98 | Joback Calculated Property |
| Cp,gas | 786.83 | J/mol×K | 973.46 | Joback Calculated Property |
| η | [0.0001460; 0.0012942] | Pa×s | [432.69; 760.61] |
|
| η | 0.0012942 | Pa×s | 432.69 | Joback Calculated Property |
| η | 0.0007336 | Pa×s | 487.34 | Joback Calculated Property |
| η | 0.0004663 | Pa×s | 542.00 | Joback Calculated Property |
| η | 0.0003220 | Pa×s | 596.65 | Joback Calculated Property |
| η | 0.0002367 | Pa×s | 651.30 | Joback Calculated Property |
| η | 0.0001824 | Pa×s | 705.96 | Joback Calculated Property |
| η | 0.0001460 | Pa×s | 760.61 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Naphthaleneacetic acid, hept-2-yl ester.
Sources
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