- InChI
- InChI=1S/C25H23N3/c1-28(2)23-15-13-19(14-16-23)22-17-24(20-9-5-3-6-10-20)26-27-25(18-22)21-11-7-4-8-12-21/h3-17H,18H2,1-2H3
- InChI Key
- VXVJBLRSHSQLAK-UHFFFAOYSA-N
- Formula
- C25H23N3
- SMILES
-
CN(C)c1ccc(C2=CC(c3ccccc3)=NN=
C(c3ccccc3)C2)cc1 - Molecular Weight1
- 365.47
- CAS
- 32059-53-3
- Other Names
-
- 3,7-Diphenyl-5-(p-dimethylaminophenyl)-1,2(4H)-diazepine
- 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).
- 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° | 912.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 555.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.97 | kJ/mol | Joback Calculated Property |
| log10WS | -6.11 | Crippen Calculated Property | |
| logPoct/wat | 5.433 | Crippen Calculated Property | |
| McVol | 298.010 | ml/mol | McGowan Calculated Property |
| Pc | 1867.55 | kPa | Joback Calculated Property |
| Tboil | 1017.17 | K | Joback Calculated Property |
| Tc | 1301.19 | K | Joback Calculated Property |
| Tfus | 686.78 | K | Joback Calculated Property |
| Vc | 1.111 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [980.16; 1021.95] | J/mol×K | [1017.17; 1301.19] | 
|
| Cp,gas | 980.16 | J/mol×K | 1017.17 | Joback Calculated Property |
| Cp,gas | 992.75 | J/mol×K | 1064.51 | Joback Calculated Property |
| Cp,gas | 1002.92 | J/mol×K | 1111.84 | Joback Calculated Property |
| Cp,gas | 1010.80 | J/mol×K | 1159.18 | Joback Calculated Property |
| Cp,gas | 1016.51 | J/mol×K | 1206.51 | Joback Calculated Property |
| Cp,gas | 1020.19 | J/mol×K | 1253.85 | Joback Calculated Property |
| Cp,gas | 1021.95 | J/mol×K | 1301.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,7-Diphenyl-5-(p-dimethylaminophenyl)-1,2-diazepin.
Sources
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