- InChI
- InChI=1S/C5H4ClN/c6-5-2-1-3-7-4-5/h1-4H
- InChI Key
- PWRBCZZQRRPXAB-UHFFFAOYSA-N
- Formula
- C5H4ClN
- SMILES
- Clc1cccnc1
- Molecular Weight1
- 113.55
- CAS
- 626-60-8
- Other Names
-
- m-Chloropyridine
- 3-Chloropyridine
- «beta»-Chloropyridine
- ω : Acentric Factor.
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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 | 0.2651 | Relay (1.0) Calculated Property | |
| PAff | 903.40 | kJ/mol | NIST |
| BasG | 871.50 | kJ/mol | NIST |
| ΔfG° | 158.70 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 115.06 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 47.90 ± 1.10 | kJ/mol | NIST |
| IE | [9.10; 9.80] | eV |
|
| IE | 9.10 | eV | NIST |
| IE | 9.80 ± 0.10 | eV | NIST |
| IE | 9.65 | eV | NIST |
| IE | 9.58 | eV | NIST |
| log10WS | -0.11 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.735 | Crippen Calculated Property | |
| McVol | 79.770 | ml/mol | McGowan Calculated Property |
| Pc | 5189.09 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [861.10; 890.00] |
|
|
| Inp | 884.50 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 887.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | Outlier 861.10 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Tboil | 421.20 | K | NIST |
| Tc | 688.80 | K | Relay (1.0) Calculated Property |
| Tfus | 271.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.282 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Pyridine, 3-chloro-.
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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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.