- InChI
- InChI=1S/C5H4O2/c6-3-5-1-2-7-4-5/h1-4H
- InChI Key
- AZVSIHIBYRHSLB-UHFFFAOYSA-N
- Formula
- C5H4O2
- SMILES
- O=Cc1ccoc1
- Molecular Weight1
- 96.08
- CAS
- 498-60-2
- Other Names
-
- 3-Furancarboxaldehyde
- 3-Formylfuran
- 3-Furancarbaldehyde
- 3-Furfural
- Furan-3-carboxaldehyde
- 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboilr : Boiling point at reduced pressure (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔvapH° | 48.10 ± 0.50 | kJ/mol | NIST |
| log10WS | -5.45 | Crippen Calculated Property | |
| logPoct/wat | 1.092 | Crippen Calculated Property | |
| McVol | 69.290 | ml/mol | McGowan Calculated Property |
| Inp | [801.00; 862.00] |
|
|
| Inp | 804.00 | NIST | |
| Inp | 806.00 | NIST | |
| Inp | 815.00 | NIST | |
| Inp | 831.70 | NIST | |
| Inp | 837.00 | NIST | |
| Inp | 801.00 | NIST | |
| Inp | 833.00 | NIST | |
| Inp | 812.00 | NIST | |
| Inp | 842.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 815.00 | NIST | |
| Inp | 823.00 | NIST | |
| Inp | 846.00 | NIST | |
| Inp | 832.00 | NIST | |
| Inp | 831.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 833.00 | NIST | |
| I | [1426.00; 1483.00] |
|
|
| I | 1458.00 | NIST | |
| I | 1454.00 | NIST | |
| I | 1448.00 | NIST | |
| I | 1437.00 | NIST | |
| I | 1455.00 | NIST | |
| I | 1426.00 | NIST | |
| I | Outlier 1483.00 | NIST | |
| I | 1454.00 | NIST | |
| I | 1458.00 | NIST | |
| I | 1455.00 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [344.20; 417.20] | K | [5.70; 97.60] |
|
| Tboilr | 344.20 | K | 5.70 | NIST |
| Tboilr | 417.20 | K | 97.60 | NIST |
Similar Compounds
Find more compounds similar to 3-Furaldehyde.
Sources
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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.