- InChI
- InChI=1S/C15H20O/c1-2-3-4-8-11-15(16)13-12-14-9-6-5-7-10-14/h5-7,9-10,12-13H,2-4,8,11H2,1H3/b13-12+
- InChI Key
- NUWFGSCHUJWGHJ-OUKQBFOZSA-N
- Formula
- C15H20O
- SMILES
- CCCCCCC(=O)C=Cc1ccccc1
- Molecular Weight1
- 216.32
- CAS
- 30669-47-7
- Other Names
-
- «alpha»-n-Hexyl cinnamic aldehyde
- 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.
- 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° | 139.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -111.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.96 | kJ/mol | Joback Calculated Property |
| log10WS | -4.51 | Crippen Calculated Property | |
| logPoct/wat | 4.239 | Crippen Calculated Property | |
| McVol | 195.720 | ml/mol | McGowan Calculated Property |
| Pc | 2043.76 | kPa | Joback Calculated Property |
| Inp | [1727.00; 1727.00] |
|
|
| Inp | 1727.00 | NIST | |
| Inp | 1727.00 | NIST | |
| I | 2309.00 | NIST | |
| Tboil | 627.31 | K | Joback Calculated Property |
| Tc | 834.32 | K | Joback Calculated Property |
| Tfus | 330.08 | K | Joback Calculated Property |
| Vc | 0.753 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [497.75; 583.89] | J/mol×K | [627.31; 834.32] |
|
| Cp,gas | 497.75 | J/mol×K | 627.31 | Joback Calculated Property |
| Cp,gas | 514.47 | J/mol×K | 661.81 | Joback Calculated Property |
| Cp,gas | 530.17 | J/mol×K | 696.31 | Joback Calculated Property |
| Cp,gas | 544.91 | J/mol×K | 730.81 | Joback Calculated Property |
| Cp,gas | 558.73 | J/mol×K | 765.32 | Joback Calculated Property |
| Cp,gas | 571.71 | J/mol×K | 799.82 | Joback Calculated Property |
| Cp,gas | 583.89 | J/mol×K | 834.32 | Joback Calculated Property |
| η | [0.0001482; 0.0025373] | Pa×s | [330.08; 627.31] |
|
| η | 0.0025373 | Pa×s | 330.08 | Joback Calculated Property |
| η | 0.0011605 | Pa×s | 379.62 | Joback Calculated Property |
| η | 0.0006358 | Pa×s | 429.16 | Joback Calculated Property |
| η | 0.0003946 | Pa×s | 478.69 | Joback Calculated Property |
| η | 0.0002678 | Pa×s | 528.23 | Joback Calculated Property |
| η | 0.0001942 | Pa×s | 577.77 | Joback Calculated Property |
| η | 0.0001482 | Pa×s | 627.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Nonen-3-one, 1-phenyl-.
Sources
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