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| CAS No.: | 624734-19-6 |
|---|---|
| Name: | 4H-PYRAN-4-ONE, 3-FLUOROTETRAHYDRO- |
| Article Data: | 13 |
| Molecular Structure: | |
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| Formula: | C5H7FO2 |
| Molecular Weight: | 118.108 |
| Synonyms: | 3-Fluorotetrahydro-4H-pyran-4-one; |
| Density: | 1.15 g/cm3 |
| Boiling Point: | 156.9 °C at 760 mmHg |
| Flash Point: | 48 °C |
| Hazard Symbols: | Xn |
| Risk Codes: | 22 |
| PSA: | 26.30000 |
| LogP: | 0.31390 |
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- Total:34 Page 1 of 1 1
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Specification
This chemical is called 4H-Pyran-4-one, 3-fluorotetrahydro-, and its systematic name is 3-fluorotetrahydro-4H-pyran-4-one. With the molecular formula of C5H7FO2, its molecular weight is 118.11. The CAS registry number of this chemical is 624734-19-6.
Other characteristics of the 4H-Pyran-4-one, 3-fluorotetrahydro- can be summarised as followings: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 10.39; (4)ACD/KOC (pH 7.4): 10.39; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 26.3 Å2; (9)Index of Refraction: 1.407; (10)Molar Refractivity: 25.1 cm3; (11)Molar Volume: 101.8 cm3; (12)Polarizability: 9.95×10-24cm3; (13)Surface Tension: 27.4 dyne/cm; (14)Density: 1.15 g/cm3; (15)Flash Point: 48 °C; (16)Enthalpy of Vaporization: 39.36 kJ/mol; (17)Boiling Point: 156.9 °C at 760 mmHg; (18)Vapour Pressure: 2.83 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C1CCOCC1F
2.InChI: InChI=1/C5H7FO2/c6-4-3-8-2-1-5(4)7/h4H,1-3H2
3.InChIKey: QORMSHMHGGKSSD-UHFFFAOYAL