- InChI
- InChI=1S/C23H29N3O/c27-19-18-25-16-14-24(15-17-25)12-5-13-26-22-8-3-1-6-20(22)10-11-21-7-2-4-9-23(21)26/h1-4,6-11,27H,5,12-19H2
- InChI Key
- YNZFUWZUGRBMHL-UHFFFAOYSA-N
- Formula
- C23H29N3O
- SMILES
-
OCCN1CCN(CCCN2c3ccccc3C=Cc3ccc
cc32)CC1 - Molecular Weight1
- 363.50
- CAS
- 315-72-0
- Other Names
-
- 1-Piperazineethanol, 4-[3-(5H-dibenz[b,f]azepin-5-yl)propyl]-
- Endison
- G 33040
- GR 33040
- N-[3-[4-(2-Hydroxyethyl)-piperazino]propyl]iminostilbene
- Nisidana
- Opipramol G
- Opramidol
- Insidon (free base)
- Insidon, base
- Pramolan (free base)
- 4-(3-(5H-Dibenz(b,f)azepin-5-yl)propyl)-1-piperazineethanol
- 5H-Dibenz(b,f)azepine, 5-(3-(4-(2-hydroxyethyl)-1-piperazinyl)propyl)-
- NSC 169867
- 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).
- 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 | 0.9731 | Relay (1.0) Calculated Property | |
| ΔfG° | 432.15 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 82.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 144.80 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.56 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.309 | Crippen Calculated Property | |
| McVol | 297.200 | ml/mol | McGowan Calculated Property |
| Pc | 1331.82 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 765.71 | K | Relay (1.0) Calculated Property |
| Tc | 1062.76 | K | Relay (1.0) Calculated Property |
| Tfus | 397.60 | K | Relay (1.0) Calculated Property |
| Vc | 1.057 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Opipramol.
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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