- InChI
- InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3
- InChI Key
- SOYKEARSMXGVTM-UHFFFAOYSA-N
- Formula
- C16H19ClN2
- SMILES
- CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
- Molecular Weight1
- 274.79
- CAS
- 25523-97-1
- Other Names
-
- S-(+)-Chlorpheniramine
- (+)-Chlorpheniramine
- 2-Pyridinepropanamine, «gamma»-(4-chlorophenyl)-N,N-dimethyl-, (S)-
- Pyridine, 2-[p-chloro-«alpha»-[2-(dimethylamino)ethyl]benzyl]-, (S)-(+)-
- D-Chlorpheniramine
- Polaramine
- «gamma»-(4-Chlorophenyl)-N,N-dimethyl-2-pyridinepropanamine
- 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 | 0.5463 | Relay (1.0) Calculated Property | |
| ΔfG° | 353.32 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 136.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 89.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.24 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.65 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.819 | Crippen Calculated Property | |
| McVol | 220.980 | ml/mol | McGowan Calculated Property |
| Pc | 2202.43 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 621.49 | K | Relay (1.0) Calculated Property |
| Tc | 866.34 | K | Relay (1.0) Calculated Property |
| Tfus | 355.88 | K | Relay (1.0) Calculated Property |
| Vc | 0.788 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Dexchlorpheniramine.
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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