- InChI
- InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-11(2)10-12/h10-11H,3-9H2,1-2H3
- InChI Key
- LBICMZLDYMBIGA-UHFFFAOYSA-N
- Formula
- C11H22O
- SMILES
- CCCCCCCCC(C)C=O
- Molecular Weight1
- 170.30
- Other Names
-
- 2-methyldecan-1-al
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.5762 | Relay (1.0) Calculated Property | |
| ΔfG° | -60.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -367.44 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.58 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.51 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.572 | Crippen Calculated Property | |
| McVol | 167.420 | ml/mol | McGowan Calculated Property |
| Pc | 2081.22 | kPa | Joback Calculated Property |
| Inp | [1251.00; 1274.00] |
|
|
| Inp | 1274.00 | NIST | |
| Inp | 1251.00 | NIST | |
| Inp | 1274.00 | NIST | |
| Inp | 1251.00 | NIST | |
| Tboil | 481.40 | K | Relay (1.0) Calculated Property |
| Tc | 672.25 | K | Relay (1.0) Calculated Property |
| Tfus | 252.77 | K | Relay (1.0) Calculated Property |
| Vc | 0.640 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [243.43; 578.15] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 2.60700e+00 | |||
| Coefficient B | 1.02924e+00 | |||
| Coefficient C | -5.70800e-04 | |||
| Coefficient D | 1.17100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 243.43 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 300.47 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 351.69 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 397.45 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 438.12 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 474.08 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 505.69 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 533.32 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 557.35 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 578.15 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0076580; 0.0003155] | Pa×s | [240.73; 469.24] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.14215e+01 | |||
| Coefficient B | 1.57665e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 240.73 | |||
| Temperature range, max. | 469.24 | |||
| η | 0.0076580 | Pa×s | 240.73 | Calculated Property |
| η | 0.0040996 | Pa×s | 266.12 | Calculated Property |
| η | 0.0024470 | Pa×s | 291.51 | Calculated Property |
| η | 0.0015865 | Pa×s | 316.90 | Calculated Property |
| η | 0.0010969 | Pa×s | 342.29 | Calculated Property |
| η | 0.0007980 | Pa×s | 367.68 | Calculated Property |
| η | 0.0006050 | Pa×s | 393.07 | Calculated Property |
| η | 0.0004743 | Pa×s | 418.46 | Calculated Property |
| η | 0.0003823 | Pa×s | 443.85 | Calculated Property |
| η | 0.0003155 | Pa×s | 469.24 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-decanal.
Sources
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