- InChI
- InChI=1S/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
- InChI Key
- IEMMBWWQXVXBEU-UHFFFAOYSA-N
- Formula
- C6H6O2
- SMILES
- CC(=O)c1ccco1
- Molecular Weight1
- 110.11
- CAS
- 1192-62-7
- Other Names
-
- (2-Furanyl)-1-ethanone
- 1-(2-Furanyl)-ethanone (2-acetylfuran)
- 1-(2-Furanyl)ethanone
- 1-(2-furanyl)ethanone (acetylfuran)
- 2-Acetylfurane
- 2-acetylfuran
- 2-furyl methyl ketone
- Acetylfuran
- Furan, 2-acetyl-
- Ketone, 2-furyl methyl
- Methyl 2-furyl ketone
- furyl methyl ketone
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 15.51 | kJ/mol | Enthalp... |
| ΔvapH° | 53.00 ± 0.60 | kJ/mol | NIST |
| IE | [9.02; 9.27] | eV |
|
| IE | 9.02 | eV | NIST |
| IE | 9.27 ± 0.05 | eV | NIST |
| log10WS | -5.87 | Crippen Calculated Property | |
| logPoct/wat | 1.482 | Crippen Calculated Property | |
| McVol | 83.380 | ml/mol | McGowan Calculated Property |
| Inp | [870.00; 930.00] |
|
|
| Inp | 886.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 887.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 916.00 | NIST | |
| Inp | 929.00 | NIST | |
| Inp | 927.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 909.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 923.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 887.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 925.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 925.00 | NIST | |
| Inp | 915.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 911.00 | NIST | |
| Inp | 912.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 915.00 | NIST | |
| Inp | 911.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 911.00 | NIST | |
| Inp | 930.00 | NIST | |
| Inp | 928.00 | NIST | |
| Inp | 911.20 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 921.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 918.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 912.00 | NIST | |
| Inp | 913.00 | NIST | |
| Inp | 918.00 | NIST | |
| Inp | 918.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 916.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 911.00 | NIST | |
| Inp | 917.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 927.00 | NIST | |
| Inp | 909.00 | NIST | |
| Inp | 923.00 | NIST | |
| Inp | 883.00 | NIST | |
| I | [1457.00; 1538.00] |
|
|
| I | 1498.00 | NIST | |
| I | 1505.00 | NIST | |
| I | 1483.00 | NIST | |
| I | 1512.00 | NIST | |
| I | 1475.00 | NIST | |
| I | 1482.00 | NIST | |
| I | 1488.00 | NIST | |
| I | 1482.00 | NIST | |
| I | 1501.00 | NIST | |
| I | 1488.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1510.00 | NIST | |
| I | 1510.00 | NIST | |
| I | 1496.00 | NIST | |
| I | 1475.00 | NIST | |
| I | 1497.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1479.00 | NIST | |
| I | 1475.00 | NIST | |
| I | 1511.00 | NIST | |
| I | 1511.00 | NIST | |
| I | 1498.00 | NIST | |
| I | 1489.00 | NIST | |
| I | 1488.00 | NIST | |
| I | 1511.00 | NIST | |
| I | 1506.00 | NIST | |
| I | 1493.00 | NIST | |
| I | 1498.00 | NIST | |
| I | 1505.00 | NIST | |
| I | 1511.00 | NIST | |
| I | 1501.00 | NIST | |
| I | Outlier 1457.00 | NIST | |
| I | 1514.00 | NIST | |
| I | 1497.00 | NIST | |
| I | 1495.00 | NIST | |
| I | 1491.00 | NIST | |
| I | 1481.00 | NIST | |
| I | 1498.00 | NIST | |
| I | 1499.00 | NIST | |
| I | 1499.00 | NIST | |
| I | 1495.00 | NIST | |
| I | 1511.00 | NIST | |
| I | 1519.00 | NIST | |
| I | 1507.00 | NIST | |
| I | 1489.00 | NIST | |
| I | Outlier 1538.00 | NIST | |
| I | 1498.00 | NIST | |
| I | Outlier 1536.00 | NIST | |
| I | 1487.00 | NIST | |
| I | 1488.00 | NIST | |
| I | 1488.00 | NIST | |
| I | 1490.00 | NIST | |
| I | 1491.00 | NIST | |
| I | 1494.00 | NIST | |
| I | Outlier 1534.00 | NIST | |
| I | 1527.00 | NIST | |
| I | 1501.00 | NIST | |
| I | 1518.00 | NIST | |
| I | 1512.00 | NIST | |
| I | 1512.00 | NIST | |
| I | 1489.00 | NIST | |
| I | 1504.00 | NIST | |
| I | 1524.00 | NIST | |
| I | 1511.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1499.00 | NIST | |
| I | 1519.00 | NIST | |
| I | 1519.00 | NIST | |
| I | Outlier 1534.00 | NIST | |
| I | 1523.00 | NIST | |
| I | Outlier 1536.00 | NIST | |
| I | Outlier 1536.00 | NIST | |
| I | Outlier 1536.00 | NIST | |
| I | 1515.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1524.00 | NIST | |
| I | 1484.00 | NIST | |
| I | Outlier 1463.00 | NIST | |
| I | Outlier 1465.00 | NIST | |
| I | 1467.00 | NIST | |
| I | 1499.00 | NIST | |
| I | Outlier 1463.00 | NIST | |
| I | 1497.00 | NIST | |
| I | 1470.00 | NIST | |
| I | Outlier 1463.00 | NIST | |
| I | 1490.00 | NIST | |
| I | 1496.00 | NIST | |
| I | 1490.00 | NIST | |
| I | 1490.00 | NIST | |
| I | 1507.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1503.00 | NIST | |
| I | 1488.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1509.00 | NIST | |
| I | 1511.00 | NIST | |
| I | 1522.00 | NIST | |
| I | 1507.00 | NIST | |
| I | 1483.00 | NIST | |
| I | 1518.00 | NIST | |
| I | 1489.00 | NIST | |
| I | 1518.00 | NIST | |
| I | 1492.00 | NIST | |
| I | 1490.00 | NIST | |
| I | 1498.00 | NIST | |
| I | 1490.00 | NIST | |
| I | 1509.00 | NIST | |
| I | 1509.00 | NIST | |
| I | 1510.00 | NIST | |
| I | 1502.00 | NIST | |
| I | 1502.00 | NIST | |
| I | 1490.00 | NIST | |
| I | 1516.00 | NIST | |
| I | 1497.00 | NIST | |
| I | 1519.00 | NIST | |
| I | 1491.00 | NIST | |
| I | 1504.00 | NIST | |
| I | 1527.00 | NIST | |
| I | 1485.00 | NIST | |
| I | 1491.00 | NIST | |
| I | Outlier 1461.00 | NIST | |
| I | 1483.00 | NIST | |
| I | 1500.00 | NIST | |
| I | 1483.00 | NIST | |
| I | 1490.00 | NIST | |
| I | 1510.00 | NIST | |
| I | 1497.00 | NIST | |
| I | 1485.00 | NIST | |
| Tboil | 446.00 | K | NIST |
| Tfus | 306.00 | K | NIST |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔfusH | 15.50 | kJ/mol | 301.60 | NIST |
| Pvap | [1.54; 39.93] | kPa | [337.95; 414.25] |
|
| Pvap | 1.54 | kPa | 337.95 | Vapor P... |
| Pvap | 2.01 | kPa | 342.65 | Vapor P... |
| Pvap | 3.06 | kPa | 349.75 | Vapor P... |
| Pvap | 3.60 | kPa | 353.10 | Vapor P... |
| Pvap | 3.62 | kPa | 353.35 | Vapor P... |
| Pvap | 4.02 | kPa | 355.05 | Vapor P... |
| Pvap | 5.18 | kPa | 360.65 | Vapor P... |
| Pvap | 5.18 | kPa | 360.86 | Vapor P... |
| Pvap | 6.02 | kPa | 363.95 | Vapor P... |
| Pvap | 7.03 | kPa | 367.65 | Vapor P... |
| Pvap | 8.03 | kPa | 370.55 | Vapor P... |
| Pvap | 9.03 | kPa | 373.55 | Vapor P... |
| Pvap | 10.04 | kPa | 376.35 | Vapor P... |
| Pvap | 15.04 | kPa | 386.55 | Vapor P... |
| Pvap | 20.07 | kPa | 394.15 | Vapor P... |
| Pvap | 29.89 | kPa | 405.55 | Vapor P... |
| Pvap | 39.93 | kPa | 414.25 | Vapor P... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [340.00; 340.20] | K | [1.30; 1.30] |
|
| Tboilr | 340.20 | K | 1.30 | NIST |
| Tboilr | 340.00 | K | 1.30 | NIST |
Similar Compounds
Find more compounds similar to Ethanone, 1-(2-furanyl)-.
Mixtures
Sources
- Crippen Method
- Crippen Method
- Enthalpies of combustion and formation of 2-acetylpyrrole, 2-acetylfuran and 2-acetylthiophene
- Vapor Pressure and Isobaric Vapor-Liquid Equilibrium for Binary Systems of Furfural, 2-Acetylfuran, and 5-Methylfurfural at 3.60 and 5.18 kPa
- McGowan Method
- NIST Webbook
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Outlier This icon means
that the value is more than 2 standard deviations away from the
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