- InChI
- InChI=1S/C16H16N2O2/c1-11-5-3-7-13(9-11)15(19)17-18-16(20)14-8-4-6-12(2)10-14/h3-10H,1-2H3,(H,17,19)(H,18,20)
- InChI Key
- GYFCOKOXDQWIOA-UHFFFAOYSA-N
- Formula
- C16H16N2O2
- SMILES
-
Cc1cccc(C(=O)NNC(=O)c2cccc(C)c
2)c1 - Molecular Weight1
- 268.31
- CAS
- 59646-36-5
- 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 | 0.7481 | Relay (1.0) Calculated Property | |
| ΔfG° | 210.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -153.34 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.28 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.63 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.378 | Crippen Calculated Property | |
| McVol | 211.880 | ml/mol | McGowan Calculated Property |
| Pc | 2576.72 | kPa | Joback Calculated Property |
| Tboil | 635.76 | K | Relay (1.0) Calculated Property |
| Tc | 958.41 | K | Relay (1.0) Calculated Property |
| Tfus | 432.63 | K | Relay (1.0) Calculated Property |
| Vc | 0.761 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [608.57; 668.82] | J/mol×K | [836.88; 1075.41] | 
|
| Cp,gas | 608.57 | J/mol×K | 836.88 | Joback Calculated Property |
| Cp,gas | 621.16 | J/mol×K | 876.64 | Joback Calculated Property |
| Cp,gas | 632.65 | J/mol×K | 916.39 | Joback Calculated Property |
| Cp,gas | 643.09 | J/mol×K | 956.15 | Joback Calculated Property |
| Cp,gas | 652.55 | J/mol×K | 995.90 | Joback Calculated Property |
| Cp,gas | 661.10 | J/mol×K | 1035.66 | Joback Calculated Property |
| Cp,gas | 668.82 | J/mol×K | 1075.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Di-(m-toluoyl)-hydrazine.
Sources
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