- InChI
- InChI=1S/C12H22O/c1-3-4-5-6-7-9-12(2)10-8-11-13/h8,10-12H,3-7,9H2,1-2H3/b10-8+
- InChI Key
- WNTNIUKAZPPRFM-CSKARUKUSA-N
- Formula
- C12H22O
- SMILES
- CCCCCCCC(C)C=CC=O
- Molecular Weight1
- 182.30
- 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° | 28.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -264.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.60 | kJ/mol | Joback Calculated Property |
| log10WS | -3.74 | Crippen Calculated Property | |
| logPoct/wat | 3.738 | Crippen Calculated Property | |
| McVol | 177.210 | ml/mol | McGowan Calculated Property |
| Pc | 2000.12 | kPa | Joback Calculated Property |
| I | [1630.00; 1630.00] |
|
|
| I | 1630.00 | NIST | |
| I | 1630.00 | NIST | |
| Tboil | 526.34 | K | Joback Calculated Property |
| Tc | 702.92 | K | Joback Calculated Property |
| Tfus | 246.92 | K | Joback Calculated Property |
| Vc | 0.699 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [419.08; 502.78] | J/mol×K | [526.34; 702.92] |
|
| Cp,gas | 419.08 | J/mol×K | 526.34 | Joback Calculated Property |
| Cp,gas | 434.74 | J/mol×K | 555.77 | Joback Calculated Property |
| Cp,gas | 449.67 | J/mol×K | 585.20 | Joback Calculated Property |
| Cp,gas | 463.92 | J/mol×K | 614.63 | Joback Calculated Property |
| Cp,gas | 477.50 | J/mol×K | 644.06 | Joback Calculated Property |
| Cp,gas | 490.44 | J/mol×K | 673.49 | Joback Calculated Property |
| Cp,gas | 502.78 | J/mol×K | 702.92 | Joback Calculated Property |
| η | [0.0002016; 0.0069575] | Pa×s | [246.92; 526.34] |
|
| η | 0.0069575 | Pa×s | 246.92 | Joback Calculated Property |
| η | 0.0024143 | Pa×s | 293.49 | Joback Calculated Property |
| η | 0.0011195 | Pa×s | 340.06 | Joback Calculated Property |
| η | 0.0006247 | Pa×s | 386.63 | Joback Calculated Property |
| η | 0.0003951 | Pa×s | 433.20 | Joback Calculated Property |
| η | 0.0002732 | Pa×s | 479.77 | Joback Calculated Property |
| η | 0.0002016 | Pa×s | 526.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Methyl-undecanal.
Sources
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