- InChI
- InChI=1S/C32H52N2O2/c1-7-13-31(27-15-19-29(20-16-27)35-25-23-33(9-3)10-4)32(14-8-2)28-17-21-30(22-18-28)36-26-24-34(11-5)12-6/h15-22,31-32H,7-14,23-26H2,1-6H3
- InChI Key
- GKMRDSMWVSUEQQ-UHFFFAOYSA-N
- Formula
- C32H52N2O2
- SMILES
-
CCCC(c1ccc(OCCN(CC)CC)cc1)C(CC
C)c1ccc(OCCN(CC)CC)cc1 - Molecular Weight1
- 496.77
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | 430.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -393.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 67.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.83 | kJ/mol | Joback Calculated Property |
| log10WS | -7.89 | Crippen Calculated Property | |
| logPoct/wat | 7.595 | Crippen Calculated Property | |
| McVol | 445.920 | ml/mol | McGowan Calculated Property |
| Pc | 738.42 | kPa | Joback Calculated Property |
| Inp | [3205.00; 3255.00] |
|
|
| Inp | 3205.00 | NIST | |
| Inp | 3205.00 | NIST | |
| Inp | 3255.00 | NIST | |
| Tboil | 1063.72 | K | Joback Calculated Property |
| Tc | 1306.60 | K | Joback Calculated Property |
| Tfus | 607.68 | K | Joback Calculated Property |
| Vc | 1.671 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1576.63; 1672.38] | J/mol×K | [1063.72; 1306.60] |
|
| Cp,gas | 1576.63 | J/mol×K | 1063.72 | Joback Calculated Property |
| Cp,gas | 1596.61 | J/mol×K | 1104.20 | Joback Calculated Property |
| Cp,gas | 1614.81 | J/mol×K | 1144.68 | Joback Calculated Property |
| Cp,gas | 1631.35 | J/mol×K | 1185.16 | Joback Calculated Property |
| Cp,gas | 1646.37 | J/mol×K | 1225.64 | Joback Calculated Property |
| Cp,gas | 1660.00 | J/mol×K | 1266.12 | Joback Calculated Property |
| Cp,gas | 1672.38 | J/mol×K | 1306.60 | Joback Calculated Property |
Similar Compounds
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Sources
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