- InChI
- InChI=1S/C9H10O2/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5,7H,6H2,1H3
- InChI Key
- NRIVMXXOUOBRAG-UHFFFAOYSA-N
- Formula
- C9H10O2
- SMILES
- COc1ccc(CC=O)cc1
- Molecular Weight1
- 150.17
- CAS
- 5703-26-4
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion 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).
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ΔfG° | -76.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -221.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.70 | kJ/mol | Joback Calculated Property |
| log10WS | -1.67 | Crippen Calculated Property | |
| logPoct/wat | 1.437 | Crippen Calculated Property | |
| McVol | 121.350 | ml/mol | McGowan Calculated Property |
| Pc | 3423.86 | kPa | Joback Calculated Property |
| I | [2090.00; 2090.00] |
|
|
| I | 2090.00 | NIST | |
| I | 2090.00 | NIST | |
| Tboil | 508.06 | K | Joback Calculated Property |
| Tc | 719.99 | K | Joback Calculated Property |
| Tfus | 294.36 | K | Joback Calculated Property |
| Vc | 0.467 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [257.62; 319.90] | J/mol×K | [508.06; 719.99] |
|
| Cp,gas | 257.62 | J/mol×K | 508.06 | Joback Calculated Property |
| Cp,gas | 269.51 | J/mol×K | 543.38 | Joback Calculated Property |
| Cp,gas | 280.78 | J/mol×K | 578.70 | Joback Calculated Property |
| Cp,gas | 291.44 | J/mol×K | 614.02 | Joback Calculated Property |
| Cp,gas | 301.51 | J/mol×K | 649.35 | Joback Calculated Property |
| Cp,gas | 310.99 | J/mol×K | 684.67 | Joback Calculated Property |
| Cp,gas | 319.90 | J/mol×K | 719.99 | Joback Calculated Property |
| η | [0.0002417; 0.0019322] | Pa×s | [294.36; 508.06] |
|
| η | 0.0019322 | Pa×s | 294.36 | Joback Calculated Property |
| η | 0.0011334 | Pa×s | 329.98 | Joback Calculated Property |
| η | 0.0007377 | Pa×s | 365.59 | Joback Calculated Property |
| η | 0.0005181 | Pa×s | 401.21 | Joback Calculated Property |
| η | 0.0003855 | Pa×s | 436.83 | Joback Calculated Property |
| η | 0.0002999 | Pa×s | 472.44 | Joback Calculated Property |
| η | 0.0002417 | Pa×s | 508.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Methoxyphenylacetaldehyde.
Sources
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