- InChI
- InChI=1S/C10H12O/c1-8-3-5-10(6-4-8)9(2)7-11/h3-7,9H,1-2H3
- InChI Key
- JTZWVKUZBNHSSW-UHFFFAOYSA-N
- Formula
- C10H12O
- SMILES
- Cc1ccc(C(C)C=O)cc1
- Molecular Weight1
- 148.20
- 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).
- Inp : Non-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° | 34.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -115.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.12 | kJ/mol | Joback Calculated Property |
| log10WS | -2.41 | Crippen Calculated Property | |
| logPoct/wat | 2.297 | Crippen Calculated Property | |
| McVol | 129.570 | ml/mol | McGowan Calculated Property |
| Pc | 3156.17 | kPa | Joback Calculated Property |
| Inp | [1210.00; 1210.00] |
|
|
| Inp | 1210.00 | NIST | |
| Inp | 1210.00 | NIST | |
| Tboil | 508.08 | K | Joback Calculated Property |
| Tc | 723.60 | K | Joback Calculated Property |
| Tfus | 268.40 | K | Joback Calculated Property |
| Vc | 0.498 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [278.08; 348.24] | J/mol×K | [508.08; 723.60] |
|
| Cp,gas | 278.08 | J/mol×K | 508.08 | Joback Calculated Property |
| Cp,gas | 291.66 | J/mol×K | 544.00 | Joback Calculated Property |
| Cp,gas | 304.45 | J/mol×K | 579.92 | Joback Calculated Property |
| Cp,gas | 316.47 | J/mol×K | 615.84 | Joback Calculated Property |
| Cp,gas | 327.76 | J/mol×K | 651.76 | Joback Calculated Property |
| Cp,gas | 338.34 | J/mol×K | 687.68 | Joback Calculated Property |
| Cp,gas | 348.24 | J/mol×K | 723.60 | Joback Calculated Property |
| η | [0.0002564; 0.0033646] | Pa×s | [268.40; 508.08] |
|
| η | 0.0033646 | Pa×s | 268.40 | Joback Calculated Property |
| η | 0.0016592 | Pa×s | 308.35 | Joback Calculated Property |
| η | 0.0009623 | Pa×s | 348.29 | Joback Calculated Property |
| η | 0.0006243 | Pa×s | 388.24 | Joback Calculated Property |
| η | 0.0004391 | Pa×s | 428.19 | Joback Calculated Property |
| η | 0.0003279 | Pa×s | 468.13 | Joback Calculated Property |
| η | 0.0002564 | Pa×s | 508.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-(4'-Methylphenyl)-propanal.
Sources
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