- InChI
- InChI=1S/C10H23NO/c1-3-5-7-11(9-10-12)8-6-4-2/h12H,3-10H2,1-2H3
- InChI Key
- IWSZDQRGNFLMJS-UHFFFAOYSA-N
- Formula
- C10H23NO
- SMILES
- CCCCN(CCO)CCCC
- Molecular Weight1
- 173.30
- Other Names
-
- (Dibutylamino)ethanol
- 2-Ethamolamine, N,N-dibutyl-
- 2-N-Dibutylaminoethanol
- 2-di-n-Butylaminoethanol
- BU2AE
- DBAE
- Di(n-butyl)ethanolamine
- Dibutylethanolamine
- Ethanol, 2-(dibutylamino)-
- N,N-(Dibutylamino)ethanol
- N,N-Dibutyl-2-hydroxyethylamine
- N,N-Dibutyl-N-(2-hydroxyethyl)amine
- N,N-Dibutylethanolamine
- N,N-di-n-Butylaminoethanol
- N,N-di-n-Butylethanolamine
- NSC 6330
- UN 2873
- «beta»-N-Dibutylaminoethyl alcohol
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 | 0.7441 | Relay (1.0) Calculated Property | |
| ΔfG° | 7.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -358.75 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.24 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.881 | Crippen Calculated Property | |
| McVol | 167.610 | ml/mol | McGowan Calculated Property |
| Pc | 2293.71 | kPa | Joback Calculated Property |
| Tboil | 502.70 | K | NIST |
| Tc | 679.86 | K | Relay (1.0) Calculated Property |
| Tfus | 198.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Vc | 0.607 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [245.63; 591.94] | 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 | -1.16020e+01 | |||
| Coefficient B | 1.11174e+00 | |||
| Coefficient C | -6.63200e-04 | |||
| Coefficient D | 1.55000e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 245.63 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 305.56 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 358.99 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 406.40 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 448.28 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 485.13 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 517.43 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 545.67 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 570.34 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 591.94 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-(DIBUTYLAMINO)ETHANOL.
Sources
- Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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