- InChI
- InChI=1S/C17H21N/c1-17(2,13-15-9-5-3-6-10-15)18-14-16-11-7-4-8-12-16/h3-12,18H,13-14H2,1-2H3
- InChI Key
- WUWANIZIMGVMSA-UHFFFAOYSA-N
- Formula
- C17H21N
- SMILES
- CC(C)(Cc1ccccc1)NCc1ccccc1
- Molecular Weight1
- 239.36
- 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° | 409.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 123.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.13 | kJ/mol | Joback Calculated Property |
| log10WS | -4.94 | Crippen Calculated Property | |
| logPoct/wat | 3.797 | Crippen Calculated Property | |
| McVol | 212.850 | ml/mol | McGowan Calculated Property |
| Pc | 2151.31 | kPa | Joback Calculated Property |
| Inp | [1760.00; 1858.00] |
|
|
| Inp | 1858.00 | NIST | |
| Inp | 1760.00 | NIST | |
| Inp | 1858.00 | NIST | |
| Inp | 1760.00 | NIST | |
| Tboil | 688.66 | K | Joback Calculated Property |
| Tc | 925.53 | K | Joback Calculated Property |
| Tfus | 389.27 | K | Joback Calculated Property |
| Vc | 0.795 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [583.77; 676.35] | J/mol×K | [688.66; 925.53] |
|
| Cp,gas | 583.77 | J/mol×K | 688.66 | Joback Calculated Property |
| Cp,gas | 602.50 | J/mol×K | 728.14 | Joback Calculated Property |
| Cp,gas | 619.76 | J/mol×K | 767.62 | Joback Calculated Property |
| Cp,gas | 635.65 | J/mol×K | 807.10 | Joback Calculated Property |
| Cp,gas | 650.30 | J/mol×K | 846.58 | Joback Calculated Property |
| Cp,gas | 663.83 | J/mol×K | 886.05 | Joback Calculated Property |
| Cp,gas | 676.35 | J/mol×K | 925.53 | Joback Calculated Property |
Similar Compounds
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Sources
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