- InChI
- InChI=1S/C13H12O2/c1-2-15-13(14)12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,2H2,1H3
- InChI Key
- XCTLDQQOHIEUCJ-UHFFFAOYSA-N
- Formula
- C13H12O2
- SMILES
- CCOC(=O)c1cccc2ccccc12
- Molecular Weight1
- 200.23
- CAS
- 3007-97-4
- Other Names
-
- 1-Naphthoic acid, ethyl ester
- Ethyl 1-naphthoate
- Ethyl «alpha»-naphthoate
- 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).
- 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° | 34.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -140.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.27 | kJ/mol | Joback Calculated Property |
| log10WS | -3.94 | Crippen Calculated Property | |
| logPoct/wat | 3.017 | Crippen Calculated Property | |
| McVol | 158.250 | ml/mol | McGowan Calculated Property |
| Pc | 2893.62 | kPa | Joback Calculated Property |
| Tboil | 623.77 | K | Joback Calculated Property |
| Tc | 854.32 | K | Joback Calculated Property |
| Tfus | 380.07 | K | Joback Calculated Property |
| Vc | 0.602 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [384.57; 454.78] | J/mol×K | [623.77; 854.32] | 
|
| Cp,gas | 384.57 | J/mol×K | 623.77 | Joback Calculated Property |
| Cp,gas | 398.55 | J/mol×K | 662.20 | Joback Calculated Property |
| Cp,gas | 411.55 | J/mol×K | 700.62 | Joback Calculated Property |
| Cp,gas | 423.62 | J/mol×K | 739.05 | Joback Calculated Property |
| Cp,gas | 434.81 | J/mol×K | 777.47 | Joback Calculated Property |
| Cp,gas | 445.18 | J/mol×K | 815.90 | Joback Calculated Property |
| Cp,gas | 454.78 | J/mol×K | 854.32 | Joback Calculated Property |
| η | [0.0002775; 0.0014189] | Pa×s | [380.07; 623.77] |
|
| η | 0.0014189 | Pa×s | 380.07 | Joback Calculated Property |
| η | 0.0009480 | Pa×s | 420.69 | Joback Calculated Property |
| η | 0.0006800 | Pa×s | 461.30 | Joback Calculated Property |
| η | 0.0005147 | Pa×s | 501.92 | Joback Calculated Property |
| η | 0.0004062 | Pa×s | 542.54 | Joback Calculated Property |
| η | 0.0003313 | Pa×s | 583.15 | Joback Calculated Property |
| η | 0.0002775 | Pa×s | 623.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Naphthalenecarboxylic acid, ethyl ester.
Sources
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