- InChI
- InChI=1S/C20H26N2/c1-19(2)17(21-15-11-7-5-8-12-15)20(3,4)18(19)22-16-13-9-6-10-14-16/h5-14,17-18,21-22H,1-4H3
- InChI Key
- QJXQIRIBSXDMJF-UHFFFAOYSA-N
- Formula
- C20H26N2
- SMILES
-
CC1(C)C(Nc2ccccc2)C(C)(C)C1Nc1
ccccc1 - Molecular Weight1
- 294.43
- CAS
- 1445-33-6
- ω : Acentric Factor.
- 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).
- 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).
- 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 | 0.5399 | Relay (1.0) Calculated Property | |
| ΔfG° | 535.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 170.12 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 114.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.33 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.014 | Crippen Calculated Property | |
| McVol | 254.240 | ml/mol | McGowan Calculated Property |
| Pc | 1883.80 | kPa | Joback Calculated Property |
| Tboil | 633.22 | K | Relay (1.0) Calculated Property |
| Tc | 957.03 | K | Relay (1.0) Calculated Property |
| Tfus | 352.37 | K | Relay (1.0) Calculated Property |
| Vc | 0.878 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [797.30; 937.02] | J/mol×K | [808.18; 1054.01] | 
|
| Cp,gas | 797.30 | J/mol×K | 808.18 | Joback Calculated Property |
| Cp,gas | 819.85 | J/mol×K | 849.15 | Joback Calculated Property |
| Cp,gas | 842.20 | J/mol×K | 890.12 | Joback Calculated Property |
| Cp,gas | 864.74 | J/mol×K | 931.10 | Joback Calculated Property |
| Cp,gas | 887.81 | J/mol×K | 972.07 | Joback Calculated Property |
| Cp,gas | 911.78 | J/mol×K | 1013.04 | Joback Calculated Property |
| Cp,gas | 937.02 | J/mol×K | 1054.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Cyclobutanediamine, n,n'-diphenyl-2,2,4,4-tetramethyl-.
Sources
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