- InChI
- InChI=1S/C12H10O2/c1-14-12(13)11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3
- InChI Key
- IODOXLXFXNATGI-UHFFFAOYSA-N
- Formula
- C12H10O2
- SMILES
- COC(=O)c1ccc2ccccc2c1
- Molecular Weight1
- 186.21
- CAS
- 2459-25-8
- Other Names
-
- 2-Naphthoic acid, methyl ester
- Methyl 2-naphthalenecarboxylate
- Methyl 2-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).
- ΔfusH : Enthalpy of fusion at a given temperature (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° | 25.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -119.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.04 | kJ/mol | Joback Calculated Property |
| log10WS | -3.52 | Crippen Calculated Property | |
| logPoct/wat | 2.626 | Crippen Calculated Property | |
| McVol | 144.160 | ml/mol | McGowan Calculated Property |
| Pc | 3217.33 | kPa | Joback Calculated Property |
| Inp | [279.47; 1651.00] |
|
|
| Inp | 1651.00 | NIST | |
| Inp | 1646.00 | NIST | |
| Inp | 279.47 | NIST | |
| Inp | 279.47 | NIST | |
| Tboil | 600.89 | K | Joback Calculated Property |
| Tc | 836.14 | K | Joback Calculated Property |
| Tfus | 350.00 ± 0.10 | K | NIST |
| Vc | 0.545 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [336.63; 402.88] | J/mol×K | [600.89; 836.14] |
|
| Cp,gas | 336.63 | J/mol×K | 600.89 | Joback Calculated Property |
| Cp,gas | 349.90 | J/mol×K | 640.10 | Joback Calculated Property |
| Cp,gas | 362.21 | J/mol×K | 679.31 | Joback Calculated Property |
| Cp,gas | 373.60 | J/mol×K | 718.51 | Joback Calculated Property |
| Cp,gas | 384.14 | J/mol×K | 757.72 | Joback Calculated Property |
| Cp,gas | 393.88 | J/mol×K | 796.93 | Joback Calculated Property |
| Cp,gas | 402.88 | J/mol×K | 836.14 | Joback Calculated Property |
| η | [0.0002966; 0.0014170] | Pa×s | [368.80; 600.89] |
|
| η | 0.0014170 | Pa×s | 368.80 | Joback Calculated Property |
| η | 0.0009648 | Pa×s | 407.48 | Joback Calculated Property |
| η | 0.0007022 | Pa×s | 446.16 | Joback Calculated Property |
| η | 0.0005377 | Pa×s | 484.85 | Joback Calculated Property |
| η | 0.0004282 | Pa×s | 523.53 | Joback Calculated Property |
| η | 0.0003519 | Pa×s | 562.21 | Joback Calculated Property |
| η | 0.0002966 | Pa×s | 600.89 | Joback Calculated Property |
| ΔfusH | 27.10 | kJ/mol | 350.20 | NIST |
Similar Compounds
Find more compounds similar to 2-Naphthalenecarboxylic acid, methyl ester.
Sources
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