- InChI
- InChI=1S/C31H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-25-33-31(32)30-28-23-18-16-21-26(28)27-22-17-19-24-29(27)30/h16-19,21-24,30H,2-15,20,25H2,1H3
- InChI Key
- LHNPJBDVFFQGID-UHFFFAOYSA-N
- Formula
- C31H44O2
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)C1c2ccc
cc2-c2ccccc21 - Molecular Weight1
- 448.68
- 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).
- 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° | 266.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -392.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 68.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.20 | kJ/mol | Joback Calculated Property |
| log10WS | -10.78 | Crippen Calculated Property | |
| logPoct/wat | 9.213 | Crippen Calculated Property | |
| McVol | 396.710 | ml/mol | McGowan Calculated Property |
| Pc | 847.02 | kPa | Joback Calculated Property |
| Inp | [2456.00; 2456.00] |
|
|
| Inp | 2456.00 | NIST | |
| Inp | 2456.00 | NIST | |
| Tboil | 1046.49 | K | Joback Calculated Property |
| Tc | 1282.09 | K | Joback Calculated Property |
| Tfus | 614.15 | K | Joback Calculated Property |
| Vc | 1.552 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1384.64; 1496.01] | J/mol×K | [1046.49; 1282.09] |
|
| Cp,gas | 1384.64 | J/mol×K | 1046.49 | Joback Calculated Property |
| Cp,gas | 1404.92 | J/mol×K | 1085.76 | Joback Calculated Property |
| Cp,gas | 1424.30 | J/mol×K | 1125.02 | Joback Calculated Property |
| Cp,gas | 1442.93 | J/mol×K | 1164.29 | Joback Calculated Property |
| Cp,gas | 1460.99 | J/mol×K | 1203.55 | Joback Calculated Property |
| Cp,gas | 1478.63 | J/mol×K | 1242.82 | Joback Calculated Property |
| Cp,gas | 1496.01 | J/mol×K | 1282.09 | Joback Calculated Property |
| η | [0.0001299; 0.0007567] | Pa×s | [614.15; 1046.49] |
|
| η | 0.0007567 | Pa×s | 614.15 | Joback Calculated Property |
| η | 0.0004835 | Pa×s | 686.21 | Joback Calculated Property |
| η | 0.0003364 | Pa×s | 758.26 | Joback Calculated Property |
| η | 0.0002493 | Pa×s | 830.32 | Joback Calculated Property |
| η | 0.0001938 | Pa×s | 902.38 | Joback Calculated Property |
| η | 0.0001563 | Pa×s | 974.43 | Joback Calculated Property |
| η | 0.0001299 | Pa×s | 1046.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9H-Fluorene-9-carboxylic acid, heptadecyl ester.
Sources
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