- InChI
- InChI=1S/C8H7NO2/c1-11-8-4-2-7(3-5-8)9-6-10/h2-5H,1H3
- InChI Key
- FMDGXCSMDZMDHZ-UHFFFAOYSA-N
- Formula
- C8H7NO2
- SMILES
- COc1ccc(N=C=O)cc1
- Molecular Weight1
- 149.15
- CAS
- 5416-93-3
- Other Names
-
- 4-Methoxyphenylisocyanate
- p-Methoxyphenyl isocyanate
- p-Methoxyphenyl 1socyanate
- p-Anisyl isocyanate
- Isocyanic acid, p-methoxyphenyl ester
- 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 | -121.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.28 | kJ/mol | Joback Calculated Property |
| log10WS | -6.07 | Crippen Calculated Property | |
| logPoct/wat | 1.662 | Crippen Calculated Property | |
| McVol | 112.940 | ml/mol | McGowan Calculated Property |
| Pc | 3843.54 | kPa | Joback Calculated Property |
| Tboil | 503.19 | K | Joback Calculated Property |
| Tc | 723.14 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-isocyanato-4-methoxy-.
Sources
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