- InChI
- InChI=1S/C17H19ClN2/c18-16-8-6-15(7-9-16)17(14-4-2-1-3-5-14)20-12-10-19-11-13-20/h1-9,17,19H,10-13H2
- InChI Key
- UZKBSZSTDQSMDR-UHFFFAOYSA-N
- Formula
- C17H19ClN2
- SMILES
-
Clc1ccc(C(c2ccccc2)N2CCNCC2)cc
1 - Molecular Weight1
- 286.80
- CAS
- 303-26-4
- Other Names
-
- Piperazine, 1-[(4-chlorophenyl)phenylmethyl]-
- N-(p-Chlorobenzhydryl)piperazine
- 1-(4-Chlorobenzhydryl)piperazine
- 4-(4-Chlorobenzhydryl)piperazine
- 1-(4-Chloro-«alpha»-phenylbenzyl)piperazine
- 1-(«alpha»-Phenyl-4-chlorobenzyl)piperazine
- Piperazine, 1-(p-chloro-«alpha»-phenylbenzyl)-
- Piperazine, 1-(«alpha»-(4-chlorophenyl)benzyl)-
- 1-[(4-Chlorophenyl)(phenyl)methyl]piperazine
- N-(4-Chlorobenzhydryl)piperazine
- NSC 86164
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.5279 | Relay (1.0) Calculated Property | |
| ΔfG° | 380.36 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 207.12 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 102.24 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.64 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.335 | Crippen Calculated Property | |
| McVol | 224.210 | ml/mol | McGowan Calculated Property |
| Pc | 2185.33 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 658.27 | K | Relay (1.0) Calculated Property |
| Tc | 924.70 | K | Relay (1.0) Calculated Property |
| Tfus | 356.30 | K | Relay (1.0) Calculated Property |
| Vc | 0.774 | m3/kmol | Relay (1.0) Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 452.20 | K | 0.07 | NIST |
Similar Compounds
Find more compounds similar to Norchlorcyclizine.
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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