- InChI
- InChI=1S/C9H15N3O3/c1-4-13-7-10-8(14-5-2)12-9(11-7)15-6-3/h4-6H2,1-3H3
- InChI Key
- ZLKYBXDNXFQYDL-UHFFFAOYSA-N
- Formula
- C9H15N3O3
- SMILES
- CCOc1nc(OCC)nc(OCC)n1
- Molecular Weight1
- 213.23
- CAS
- 884-43-5
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase 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 | 0.6413 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -5100.30 ± 1.40 | kJ/mol | NIST |
| ΔfG° | 23.29 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -481.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | -585.00 ± 1.50 | kJ/mol | NIST |
| ΔvapH° | 74.85 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.24 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.48 | Aq. Solubility Prediction | |
| logPoct/wat | 1.068 | Crippen Calculated Property | |
| McVol | 161.460 | ml/mol | McGowan Calculated Property |
| Pc | 2392.72 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 509.65 | K | Relay (1.0) Calculated Property |
| Tc | 737.35 | K | Relay (1.0) Calculated Property |
| Tfus | 303.60 | K | Relay (1.0) Calculated Property |
| Vc | 0.660 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2,4,6-Triethoxy-1,3,5-triazine.
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
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
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