![Ethanol, 2-[(2-methylpropyl)amino]-, 4-aminobenzoate (ester)](/cid/13-658-7/Ethanol-2-2-methylpropyl-amino-4-aminobenzoate-ester.png "Ethanol, 2-[(2-methylpropyl)amino]-, 4-aminobenzoate (ester)")
- InChI
- InChI=1S/C13H20N2O2/c1-10(2)9-15-7-8-17-13(16)11-3-5-12(14)6-4-11/h3-6,10,15H,7-9,14H2,1-2H3
- InChI Key
- WDICTQVBXKADBP-UHFFFAOYSA-N
- Formula
- C13H20N2O2
- SMILES
- CC(C)CNCCOC(=O)c1ccc(N)cc1
- Molecular Weight1
- 236.31
- CAS
- 2090-89-3
- Other Names
-
- Ethanol, 2-(isobutylamino)-, p-aminobenzoate (ester)
- Butethamine
- Ibylcaine
- Isobutylaminoethyl p-aminobenzoate
- Monocain
- 2-(Isobutylamino)ethanol p-aminobenzoate (ester)
- 2-(Isobutylamino)ethyl p-aminobenzoate
- 2-[(2-Methylpropyl)amino]ethanol 4-aminobenzoate (ester)
- 2-[(2-Methylpropyl)amino]ethanol 4-aminobenzoate
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 80.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -249.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.32 | kJ/mol | Joback Calculated Property |
| log10WS | -2.39 | Crippen Calculated Property | |
| logPoct/wat | 1.671 | Crippen Calculated Property | |
| McVol | 197.670 | ml/mol | McGowan Calculated Property |
| Pc | 2436.25 | kPa | Joback Calculated Property |
| Inp | 2061.00 | NIST | |
| Tboil | 727.05 | K | Joback Calculated Property |
| Tc | 941.53 | K | Joback Calculated Property |
| Tfus | 468.29 | K | Joback Calculated Property |
| Vc | 0.738 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [561.24; 634.78] | J/mol×K | [727.05; 941.53] | 
|
| Cp,gas | 561.24 | J/mol×K | 727.05 | Joback Calculated Property |
| Cp,gas | 575.84 | J/mol×K | 762.80 | Joback Calculated Property |
| Cp,gas | 589.47 | J/mol×K | 798.54 | Joback Calculated Property |
| Cp,gas | 602.15 | J/mol×K | 834.29 | Joback Calculated Property |
| Cp,gas | 613.91 | J/mol×K | 870.04 | Joback Calculated Property |
| Cp,gas | 624.78 | J/mol×K | 905.78 | Joback Calculated Property |
| Cp,gas | 634.78 | J/mol×K | 941.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethanol, 2-[(2-methylpropyl)amino]-, 4-aminobenzoate (ester).
Sources
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