- InChI
- InChI=1S/C8H9NO/c1-7-2-4-8(5-3-7)6-9-10/h2-6,10H,1H3
- InChI Key
- SRNDYVBEUZSFEZ-UHFFFAOYSA-N
- Formula
- C8H9NO
- SMILES
- Cc1ccc(C=NO)cc1
- Molecular Weight1
- 135.16
- CAS
- 3235-02-7
- Other Names
-
- p-Tolualdehyde, oxime
- p-Methylbenzaldoxime
- p-Tolualdoxime
- 4-Methylbenzaldoxime
- 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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 | -53.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.33 | kJ/mol | Joback Calculated Property |
| log10WS | -1.25 | Crippen Calculated Property | |
| logPoct/wat | 1.803 | Crippen Calculated Property | |
| McVol | 111.370 | ml/mol | McGowan Calculated Property |
| Pc | 3530.46 | kPa | Joback Calculated Property |
| Inp | [1234.00; 1234.00] |
|
|
| Inp | 1234.00 | NIST | |
| Inp | 1234.00 | NIST | |
| I | [1709.00; 1709.00] |
|
|
| I | 1709.00 | NIST | |
| I | 1709.00 | NIST | |
| Tboil | 582.96 | K | Joback Calculated Property |
| Tc | 798.49 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzaldehyde, 4-methyl-, oxime.
Sources
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