- InChI
- InChI=1S/C7H7N/c8-6-7-4-2-1-3-5-7/h1-6,8H
- InChI Key
- AFDMODCXODAXLC-UHFFFAOYSA-N
- Formula
- C7H7N
- SMILES
- N=Cc1ccccc1
- Molecular Weight1
- 105.14
- CAS
- 16118-22-2
- Other Names
-
- C6H5CH=NH
- ω : Acentric Factor.
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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).
- 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 | 0.4274 | Relay (1.0) Calculated Property | |
| PAff | 911.90 | kJ/mol | NIST |
| BasG | 879.40 | kJ/mol | NIST |
| ΔfG° | 332.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 123.00 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 56.74 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.62 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.684 | Crippen Calculated Property | |
| McVol | 91.410 | ml/mol | McGowan Calculated Property |
| Pc | 5199.48 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 500.14 | K | Relay (1.0) Calculated Property |
| Tc | 716.66 | K | Relay (1.0) Calculated Property |
| Tfus | 303.48 | K | Relay (1.0) Calculated Property |
| Vc | 0.324 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [5.82; 171.60] | J/mol×K | [100.12; 470.70] | 
|
| Cp,gas | 5.82 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 5.82 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 5.82 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 5.82 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 5.82 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 5.82 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 171.60 | J/mol×K | 470.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzenemethanimine.
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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