- InChI
- InChI=1S/C8H9NO/c1-9(10)7-8-5-3-2-4-6-8/h2-7H,1H3
- InChI Key
- AKVBBQCAQAJLKM-UHFFFAOYSA-N
- Formula
- C8H9NO
- SMILES
- C[N+]([O-])=Cc1ccccc1
- Molecular Weight1
- 135.16
- CAS
- 3376-23-6
- Other Names
-
- Nitrone, N-methyl-«alpha»-phenyl-
- «alpha»-Phenyl-N-methylnitrone
- C-Phenyl-N-methylnitrone
- N-Benzylidenemethylamine N-oxide
- N-Methyl-«alpha»-phenylnitrone
- N-Methyl-C-phenylnitrone
- N-Methylphenylnitrone
- Methylamine, N-benzylidene-, N-oxide
- Benzylidenemethylamine N-oxide
- N-(Phenylmethylene)methanamine N-oxide
- ω : Acentric Factor.
- 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 | 0.3447 | Relay (1.0) Calculated Property | |
| ΔfG° | 260.56 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 121.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 54.47 | kJ/mol | Relay (1.0) Calculated Property |
| IE | [7.89; 8.08] | eV |
|
| IE | 8.01 | eV | NIST |
| IE | 8.08 ± 0.05 | eV | NIST |
| IE | 8.01 | eV | NIST |
| IE | 7.89 | eV | NIST |
| IE | 8.01 ± 0.02 | eV | NIST |
| log10WS | -1.23 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.246 | Crippen Calculated Property | |
| McVol | 111.370 | ml/mol | McGowan Calculated Property |
| Pc | 4181.38 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 497.36 | K | Relay (1.0) Calculated Property |
| Tc | 751.28 | K | Relay (1.0) Calculated Property |
| Tfus | 343.19 | K | Relay (1.0) Calculated Property |
| Vc | 0.378 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Methanamine, N-(phenylmethylene)-, N-oxide.
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
- McGowan Method
- NIST Webbook
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