- InChI
- InChI=1S/C19H29Cl3N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-26-19(25)17-14(20)16(23)15(21)18(22)24-17/h2-13H2,1H3,(H2,23,24)
- InChI Key
- BSCYGBHZQMCVLM-UHFFFAOYSA-N
- Formula
- C19H29Cl3N2O2
- SMILES
-
CCCCCCCCCCCCCOC(=O)c1nc(Cl)c(C
l)c(N)c1Cl - Molecular Weight1
- 423.81
- 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).
- 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 | 1.1127 | Relay (1.0) Calculated Property | |
| ΔfG° | -35.70 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -557.81 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 119.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.72 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.092 | Crippen Calculated Property | |
| McVol | 318.930 | ml/mol | McGowan Calculated Property |
| Pc | 1120.80 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2069.00 | NIST | |
| Tboil | 671.45 | K | Relay (1.0) Calculated Property |
| Tc | 940.51 | K | Relay (1.0) Calculated Property |
| Tfus | 355.68 | K | Relay (1.0) Calculated Property |
| Vc | 1.189 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Picloram, tridecyl ester.
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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