- InChI
- InChI=1S/C14H20N2/c1-3-16(4-2)10-9-12-11-15-14-8-6-5-7-13(12)14/h5-8,11,15H,3-4,9-10H2,1-2H3
- InChI Key
- LSSUMOWDTKZHHT-UHFFFAOYSA-N
- Formula
- C14H20N2
- SMILES
- CCN(CC)CCc1c[nH]c2ccccc12
- Molecular Weight1
- 216.32
- CAS
- 61-51-8
- Other Names
-
- D.E.T.
- N,N-Diethyltryptamine
- Diethyltryptamine
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 0.5809 | Relay (1.0) Calculated Property | |
| ΔfG° | 328.35 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 83.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 86.19 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.55 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.60 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.570 | Crippen Calculated Property | |
| McVol | 189.160 | ml/mol | McGowan Calculated Property |
| Pc | 2438.39 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1875.00; 1910.00] |
|
|
| Inp | 1875.00 | NIST | |
| Inp | 1900.00 | NIST | |
| Inp | 1910.00 | NIST | |
| Inp | 1875.00 | NIST | |
| Tboil | 608.29 | K | Relay (1.0) Calculated Property |
| Tc | 837.78 | K | Relay (1.0) Calculated Property |
| Tfus | 323.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.693 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Indole, 3-(2-(diethylamino)ethyl)-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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