- InChI
- InChI=1S/C9H8O2/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-5,10H,1H3
- InChI Key
- NDLPUCZWTPHFHN-UHFFFAOYSA-N
- Formula
- C9H8O2
- SMILES
- Cc1cc2cc(O)ccc2o1
- Molecular Weight1
- 148.16
- CAS
- 6769-56-8
- 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).
- I : 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 | 0.5761 | Relay (1.0) Calculated Property | |
| ΔfG° | -84.44 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -201.00 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 80.94 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.447 | Crippen Calculated Property | |
| McVol | 110.490 | ml/mol | McGowan Calculated Property |
| Pc | 5087.08 | kPa | Relay (1.0-beta) Calculated Property |
| I | [2619.00; 2619.00] |
|
|
| I | 2619.00 | NIST | |
| I | 2619.00 | NIST | |
| Tboil | 547.40 | K | Relay (1.0) Calculated Property |
| Tc | 800.41 | K | Relay (1.0) Calculated Property |
| Tfus | 398.40 | K | Relay (1.0) Calculated Property |
| Vc | 0.411 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-5-hydroxybenzofuran.
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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