- InChI
- InChI=1S/C25H36O2/c1-2-3-4-5-6-7-8-9-10-11-14-20-27-25(26)21-23-18-15-17-22-16-12-13-19-24(22)23/h12-13,15-19H,2-11,14,20-21H2,1H3
- InChI Key
- CEXDNJXKGYFGNU-UHFFFAOYSA-N
- Formula
- C25H36O2
- SMILES
-
CCCCCCCCCCCCCOC(=O)Cc1cccc2ccc
cc12 - Molecular Weight1
- 368.55
- 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 | 1.0368 | Relay (1.0) Calculated Property | |
| ΔfG° | 135.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -488.58 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 53.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 123.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.08 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.23 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.237 | Crippen Calculated Property | |
| McVol | 327.330 | ml/mol | McGowan Calculated Property |
| Pc | 1103.01 | kPa | Joback Calculated Property |
| Inp | [1844.00; 1844.00] |
|
|
| Inp | 1844.00 | NIST | |
| Inp | 1844.00 | NIST | |
| Tboil | 696.79 | K | Relay (1.0) Calculated Property |
| Tc | 923.77 | K | Relay (1.0) Calculated Property |
| Tfus | 318.90 | K | Relay (1.0) Calculated Property |
| Vc | 1.231 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1054.81; 1147.18] | J/mol×K | [898.33; 1106.00] |
|
| Cp,gas | 1054.81 | J/mol×K | 898.33 | Joback Calculated Property |
| Cp,gas | 1072.68 | J/mol×K | 932.94 | Joback Calculated Property |
| Cp,gas | 1089.46 | J/mol×K | 967.55 | Joback Calculated Property |
| Cp,gas | 1105.23 | J/mol×K | 1002.16 | Joback Calculated Property |
| Cp,gas | 1120.05 | J/mol×K | 1036.77 | Joback Calculated Property |
| Cp,gas | 1134.01 | J/mol×K | 1071.38 | Joback Calculated Property |
| Cp,gas | 1147.18 | J/mol×K | 1106.00 | Joback Calculated Property |
| η | [0.0000758; 0.0007179] | Pa×s | [515.31; 898.33] |
|
| η | 0.0007179 | Pa×s | 515.31 | Joback Calculated Property |
| η | 0.0004014 | Pa×s | 579.15 | Joback Calculated Property |
| η | 0.0002519 | Pa×s | 642.98 | Joback Calculated Property |
| η | 0.0001720 | Pa×s | 706.82 | Joback Calculated Property |
| η | 0.0001251 | Pa×s | 770.66 | Joback Calculated Property |
| η | 0.0000955 | Pa×s | 834.49 | Joback Calculated Property |
| η | 0.0000758 | Pa×s | 898.33 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Naphthaleneacetic acid, tridecyl ester.
Sources
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