- InChI
- InChI=1S/C11H12N2O/c14-8-12-6-5-9-7-13-11-4-2-1-3-10(9)11/h1-4,7-8,13H,5-6H2,(H,12,14)
- InChI Key
- JQWVVJKFXINLNV-UHFFFAOYSA-N
- Formula
- C11H12N2O
- SMILES
- OC=NCCc1c[nH]c2ccccc12
- Molecular Weight1
- 188.23
- CAS
- 6502-82-5
- 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 | 0.7263 | Relay (... Calculated Property | |
| ΔfG° | 238.53 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -17.02 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 116.95 | kJ/mol | Relay (... Calculated Property |
| IE | 8.10 | eV | Relay (... Calculated Property |
| log10WS | -2.61 | Relay (... Calculated Property | |
| logPoct/wat | 1.815 | Crippen Calculated Property | |
| McVol | 148.460 | ml/mol | McGowan Calculated Property |
| Pc | 4026.36 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 2216.30 | NIST | |
| Tboil | 640.58 | K | Relay (... Calculated Property |
| Tc | 919.32 | K | Relay (... Calculated Property |
| Tfus | 384.57 | K | Relay (... Calculated Property |
| Vc | 0.530 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to N-Formyltryptamine.
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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