- InChI
- InChI=1S/C9H9ClN4O2/c1-6(15)16-3-2-14-5-13-7-8(10)11-4-12-9(7)14/h4-5H,2-3H2,1H3
- InChI Key
- WABGFEVHJMMOIL-UHFFFAOYSA-N
- Formula
- C9H9ClN4O2
- SMILES
- CC(=O)OCCn1cnc2c(Cl)ncnc21
- Molecular Weight1
- 240.65
- CAS
- 6973-54-2
- 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 | 0.6544 | Relay (1.0) Calculated Property | |
| ΔfG° | 109.12 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -157.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 92.79 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.92 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.65 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.043 | Crippen Calculated Property | |
| McVol | 158.350 | ml/mol | McGowan Calculated Property |
| Pc | 3428.19 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 600.59 | K | Relay (1.0) Calculated Property |
| Tc | 894.44 | K | Relay (1.0) Calculated Property |
| Tfus | 390.30 | K | Relay (1.0) Calculated Property |
| Vc | 0.613 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
![2-Propanone, [(9-beta-d-ribofuranosyl-9h-purin-6-yl)thio]-.](data:image/png;base64,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)
Find more compounds similar to 9H-purine-9-ethanol, 6-chloro-, acetate.
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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