- InChI
- InChI=1S/C11H24O/c1-3-4-5-6-7-8-9-10-11(2)12/h11-12H,3-10H2,1-2H3
- InChI Key
- XMUJIPOFTAHSOK-UHFFFAOYSA-N
- Formula
- C11H24O
- SMILES
- CCCCCCCCCC(C)O
- Molecular Weight1
- 172.31
- CAS
- 1653-30-1
- Other Names
-
- 2-Hydroxyundecane
- Methyl nonyl carbinol
- Undecan-2-ol
- Undecylic alcohol, sec-
- sec-Undecyl Alcohol
- 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).
- Pvap : Vapor 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 |
|---|---|---|---|
| ω | 0.7529 | Relay (1.0) Calculated Property | |
| ΔfG° | -97.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -456.15 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 24.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.24 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.80 | eV | Relay (1.0) Calculated Property |
| log10WS | [-2.94; -2.94] |
|
|
| log10WS | -2.94 | Aq. Solubility Prediction | |
| log10WS | -2.94 | Estimated Solubility | |
| logPoct/wat | 3.508 | Crippen Calculated Property | |
| McVol | 171.720 | ml/mol | McGowan Calculated Property |
| Pc | 2115.83 | kPa | Joback Calculated Property |
| Inp | [1287.00; 1288.00] |
|
|
| Inp | 1287.00 | NIST | |
| Inp | 1288.00 | NIST | |
| I | [1706.00; 1726.00] |
|
|
| I | 1706.00 | NIST | |
| I | 1726.00 | NIST | |
| I | 1723.00 | NIST | |
| I | 1712.00 | NIST | |
| Tboil | 504.25 | K | Relay (1.0) Calculated Property |
| Tc | 679.03 | K | Relay (1.0) Calculated Property |
| Tfus | 281.92 | K | Relay (1.0) Calculated Property |
| Vc | 0.677 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [428.91; 506.33] | J/mol×K | [542.82; 703.49] |
|
| Cp,gas | 428.91 | J/mol×K | 542.82 | Joback Calculated Property |
| Cp,gas | 443.16 | J/mol×K | 569.60 | Joback Calculated Property |
| Cp,gas | 456.84 | J/mol×K | 596.38 | Joback Calculated Property |
| Cp,gas | 469.99 | J/mol×K | 623.16 | Joback Calculated Property |
| Cp,gas | 482.61 | J/mol×K | 649.93 | Joback Calculated Property |
| Cp,gas | 494.72 | J/mol×K | 676.71 | Joback Calculated Property |
| Cp,gas | 506.33 | J/mol×K | 703.49 | Joback Calculated Property |
| η | [0.0000976; 0.0500348] | Pa×s | [259.55; 542.82] |
|
| η | 0.0500348 | Pa×s | 259.55 | Joback Calculated Property |
| η | 0.0079438 | Pa×s | 306.76 | Joback Calculated Property |
| η | 0.0020606 | Pa×s | 353.97 | Joback Calculated Property |
| η | 0.0007343 | Pa×s | 401.18 | Joback Calculated Property |
| η | 0.0003252 | Pa×s | 448.40 | Joback Calculated Property |
| η | 0.0001682 | Pa×s | 495.61 | Joback Calculated Property |
| η | 0.0000976 | Pa×s | 542.82 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [391.92; 528.62] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.67068e+01 | |||
| Coefficient B | -5.09095e+03 | |||
| Coefficient C | -8.18600e+01 | |||
| Temperature range, min. | 391.92 | |||
| Temperature range, max. | 528.62 | |||
| Pvap | 1.33 | kPa | 391.92 | Calculated Property |
| Pvap | 2.87 | kPa | 407.11 | Calculated Property |
| Pvap | 5.77 | kPa | 422.30 | Calculated Property |
| Pvap | 10.93 | kPa | 437.49 | Calculated Property |
| Pvap | 19.64 | kPa | 452.68 | Calculated Property |
| Pvap | 33.72 | kPa | 467.86 | Calculated Property |
| Pvap | 55.55 | kPa | 483.05 | Calculated Property |
| Pvap | 88.25 | kPa | 498.24 | Calculated Property |
| Pvap | 135.71 | kPa | 513.43 | Calculated Property |
| Pvap | 202.66 | kPa | 528.62 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Undecanol.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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