- InChI
- InChI=1S/C13H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h3-4,14H,2,5-13H2,1H3/b4-3-
- InChI Key
- MSSXLNVNZXUONF-ARJAWSKDSA-N
- Formula
- C13H26O
- SMILES
- CC/C=C\CCCCCCCCCO
- Molecular Weight1
- 198.35
- 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).
- Ip : 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 | 0.8055 | Relay (1.0) Calculated Property | |
| ΔfG° | 1.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -368.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.05 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.05 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.066 | Crippen Calculated Property | |
| McVol | 195.600 | ml/mol | McGowan Calculated Property |
| Pc | 1854.71 | kPa | Joback Calculated Property |
| Ip | [2045.00; 2090.00] |
|
|
| Ip | 2090.00 | NIST | |
| Ip | 2045.00 | NIST | |
| Ip | 2090.00 | NIST | |
| Tboil | 551.61 | K | Relay (1.0) Calculated Property |
| Tc | 739.30 | K | Relay (1.0) Calculated Property |
| Tfus | 263.94 | K | Relay (1.0) Calculated Property |
| Vc | 0.726 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [279.76; 678.10] | 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 | -1.78200e+01 | |||
| Coefficient B | 1.29282e+00 | |||
| Coefficient C | -7.97600e-04 | |||
| Coefficient D | 2.00700e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 279.76 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 348.61 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 409.83 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 464.06 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 511.93 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 554.08 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 591.13 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 623.73 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 652.51 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 678.10 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0165809; 0.0001162] | Pa×s | [292.01; 529.41] |
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 | -1.51620e+01 | |||
| Coefficient B | 3.23035e+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. | 292.01 | |||
| Temperature range, max. | 529.41 | |||
| η | 0.0165809 | Pa×s | 292.01 | Calculated Property |
| η | 0.0066310 | Pa×s | 318.39 | Calculated Property |
| η | 0.0030511 | Pa×s | 344.77 | Calculated Property |
| η | 0.0015677 | Pa×s | 371.14 | Calculated Property |
| η | 0.0008799 | Pa×s | 397.52 | Calculated Property |
| η | 0.0005307 | Pa×s | 423.90 | Calculated Property |
| η | 0.0003396 | Pa×s | 450.28 | Calculated Property |
| η | 0.0002283 | Pa×s | 476.65 | Calculated Property |
| η | 0.0001600 | Pa×s | 503.03 | Calculated Property |
| η | 0.0001162 | Pa×s | 529.41 | Calculated Property |
Similar Compounds
Find more compounds similar to (Z)10-Dodecen-1-ol.
Sources
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