- InChI
- InChI=1S/C7H7NO/c1-6-4-2-3-5-7(6)8-9/h2-5H,1H3
- InChI Key
- TWLBRQVYXPMCFK-UHFFFAOYSA-N
- Formula
- C7H7NO
- SMILES
- Cc1ccccc1N=O
- Molecular Weight1
- 121.14
- CAS
- 611-23-4
- Other Names
-
- Toluene, o-nitroso-
- o-Methylnitrosobenzene
- o-Nitrosotoluene
- 1-Methyl-2-nitrosobenzene
- 2-Methyl-1-nitrosobenzene
- 2-Nitrosotoluene
- Nitrosotoluene
- ΔfH°gas : Enthalpy of formation 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -130.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.21 | kJ/mol | Joback Calculated Property |
| log10WS | -2.71 | Crippen Calculated Property | |
| logPoct/wat | 2.393 | Crippen Calculated Property | |
| McVol | 97.280 | ml/mol | McGowan Calculated Property |
| Pc | 3945.61 | kPa | Joback Calculated Property |
| Tboil | 454.62 | K | Joback Calculated Property |
| Tc | 666.63 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-methyl-2-nitroso-.
Sources
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