- InChI
- InChI=1S/C12H16N2O/c1-14(2)7-6-9-8-13-10-4-3-5-11(15)12(9)10/h3-5,8,13,15H,6-7H2,1-2H3
- InChI Key
- SPCIYGNTAMCTRO-UHFFFAOYSA-N
- Formula
- C12H16N2O
- SMILES
- CN(C)CCc1c[nH]c2cccc(O)c12
- Molecular Weight1
- 204.27
- CAS
- 520-53-6
- Other Names
-
- 1H-Indol-4-ol, 3-[2-(dimethylamino)ethyl]-
- Indol-4-ol, 3-[2-(dimethylamino)ethyl]-
- CX 59
- N,N-Dimethyl-4-Hydroxytryptamine
- Psilocine
- 4-Hydroxy-N,N-dimethyltryptamine
- 3-(2-(Dimethylamino)ethyl)indol-4-ol
- Psilotsin
- 3-[2-(dimethylamino)ethyl]-1H-indol-4-ol
- 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 | 0.6895 | Relay (... Calculated Property | |
| ΔfG° | 175.09 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -41.14 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 97.64 | kJ/mol | Relay (... Calculated Property |
| IE | 7.37 | eV | Relay (... Calculated Property |
| log10WS | -2.28 | Relay (... Calculated Property | |
| logPoct/wat | 1.496 | Crippen Calculated Property | |
| McVol | 166.850 | ml/mol | McGowan Calculated Property |
| Pc | 3294.05 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1929.00; 1980.00] |
|
|
| Inp | 1980.00 | NIST | |
| Inp | 1967.00 | NIST | |
| Inp | Outlier 1929.00 | NIST | |
| Inp | 1968.00 | NIST | |
| Inp | 1980.00 | NIST | |
| Inp | 1980.00 | NIST | |
| Inp | 1967.00 | NIST | |
| Tboil | 609.09 | K | Relay (... Calculated Property |
| Tc | 886.14 | K | Relay (... Calculated Property |
| Tfus | 442.81 | K | Relay (... Calculated Property |
| Vc | 0.602 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Psilocin.
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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Take the time to validate and double check the source of the data.
Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.