- InChI
- InChI=1S/C13H10N2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13/h1-10H
- InChI Key
- CMESPBFFDMPSIY-UHFFFAOYSA-N
- Formula
- C13H10N2
- SMILES
- C(=Nc1ccccc1)=Nc1ccccc1
- Molecular Weight1
- 194.23
- CAS
- 622-16-2
- Other Names
-
- Carbodiimide, diphenyl-
- Diphenylcarbodiimide
- N,N'-Diphenylcarbodiimide
- 1,3-Diphenylcarbodiimide
- N,N'-Methanetetraylbis(benzenamine)
- Carbodiimide
- Stabilizer 2013-P
- ω : Acentric Factor.
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,liquid : Liquid phase heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- S°liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (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 | 0.5201 | Relay (1.0) Calculated Property | |
| ΔcH°liquid | -6830.80 ± 3.70 | kJ/mol | NIST |
| ΔfG° | 469.83 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 449.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°liquid | 286.00 ± 3.70 | kJ/mol | NIST |
| ΔvapH° | 70.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.01 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.14 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.824 | Crippen Calculated Property | |
| McVol | 157.870 | ml/mol | McGowan Calculated Property |
| Pc | 2566.29 | kPa | Joback Calculated Property |
| S°liquid | 330.00 | J/mol×K | NIST |
| Tboil | 568.98 | K | Relay (1.0) Calculated Property |
| Tc | 848.79 | K | Relay (1.0) Calculated Property |
| Tfus | 341.87 | K | Relay (1.0) Calculated Property |
| Ttriple | 287.41 ± 0.02 | K | NIST |
| Vc | 0.581 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | 304.60 | J/mol×K | 298.15 | NIST |
| ΔfusH | [18.55; 18.55] | kJ/mol | [287.40; 287.41] | 
|
| ΔfusH | 18.55 | kJ/mol | 287.40 | NIST |
| ΔfusH | 18.55 | kJ/mol | 287.40 | NIST |
| ΔfusH | 18.55 | kJ/mol | 287.41 | NIST |
| ΔvapH | 65.60 | kJ/mol | 549.50 | NIST |
| ΔfusS | 64.54 | J/mol×K | 287.41 | NIST |
Similar Compounds
Find more compounds similar to Benzenamine, N,N'-methanetetraylbis-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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