- InChI
- InChI=1S/C6H3Cl4N/c7-5-3-1-2-4(11-5)6(8,9)10/h1-3H
- InChI Key
- DCUJJWWUNKIJPH-UHFFFAOYSA-N
- Formula
- C6H3Cl4N
- SMILES
- Clc1cccc(C(Cl)(Cl)Cl)n1
- Molecular Weight1
- 230.91
- CAS
- 1929-82-4
- Other Names
-
- 2-Chloro-6-(trichloromethyl)pyridine
- 2-Picoline, «alpha»,«alpha»,«alpha»,6-tetrachloro-
- 2-Picoline, «alpha»,«alpha»,«alpha»,6-tetrachloro-
- Dowco-163
- N-Serve
- N-Serve nitrogen stabilizer
- Pyridine, 2-chloro-6-(trichloromethyl)-
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,solid : Solid phase heat capacity (J/mol×K).
- ΔfH°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- S°solid,1 bar : Solid phase molar entropy at standard conditions (J/mol×K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°liquid | -2711.00 ± 20.00 | kJ/mol | NIST |
| ΔcH°solid | -2830.80 ± 1.60 | kJ/mol | NIST |
| ΔfH°liquid | 498.30 | kJ/mol | NIST |
| ΔfH°solid | -55.40 ± 1.80 | kJ/mol | NIST |
| ΔvapH° | 58.70 | kJ/mol | NIST |
| log10WS | [-3.76; -3.76] |
|
|
| log10WS | -3.76 | Aq. Sol... | |
| log10WS | -3.76 | Estimat... | |
| logPoct/wat | 3.562 | Crippen Calculated Property | |
| McVol | 130.580 | ml/mol | McGowan Calculated Property |
| S°solid,1 bar | 244.60 | J/mol×K | NIST |
| Tfus | 339.03 ± 0.20 | K | NIST |
| Ttriple | 337.24 ± 0.01 | K | NIST |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,solid | [189.35; 192.09] | J/mol×K | [297.13; 298.15] |
|
| Cp,solid | 192.09 | J/mol×K | 297.13 | NIST |
| Cp,solid | 189.35 | J/mol×K | 298.15 | NIST |
| ΔfusH | [20.30; 20.30] | kJ/mol | [164.50; 337.24] |
|
| ΔfusH | 20.30 | kJ/mol | 164.50 | NIST |
| ΔfusH | 20.30 | kJ/mol | 337.20 | NIST |
| ΔfusH | 20.30 | kJ/mol | 337.24 | NIST |
| ΔfusH | 20.30 | kJ/mol | 337.24 | NIST |
| ΔfusS | [60.19; 60.19] | J/mol×K | [337.24; 337.24] |
|
| ΔfusS | 60.19 | J/mol×K | 337.24 | NIST |
| ΔfusS | 60.19 | J/mol×K | 337.24 | NIST |
Similar Compounds
Find more compounds similar to Nitrapyrin.
Sources
- Crippen Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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