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CAS No.: | 14313-09-8 |
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Name: | Ethanone, 1-(3-furanyl)- (9CI) |
Article Data: | 21 |
Molecular Structure: | |
Formula: | C6H6O2 |
Molecular Weight: | 110.112 |
Synonyms: | Ketone,3-furyl methyl (7CI,8CI);1-Furan-3-ylethanone;3-Acetylfuran;b-Acetylfuran; |
Density: | 1.061 g/cm3 |
Melting Point: | 47 °C |
Boiling Point: | 148.1 °C at 760 mmHg |
Flash Point: | 59.9 °C |
Solubility: | Slightly soluble in water. |
PSA: | 30.21000 |
LogP: | 1.48220 |
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The Ethanone,1-(3-furanyl)-, with the CAS registry number 14313-09-8, is also known as 1-(3-Furyl)ethanone. It belongs to the product category of Acetylgroup. This chemical's molecular formula is C6H6O2 and molecular weight is 110.11064. Its IUPAC name is called 1-(furan-3-yl)ethanone.
Physical properties of Ethanone,1-(3-furanyl)-: (1)ACD/LogP: 0.82; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 1; (4)Index of Refraction: 1.463; (5)Molar Refractivity: 28.58 cm3; (6)Molar Volume: 103.7 cm3; (7)Surface Tension: 31.8 dyne/cm; (8)Density: 1.061 g/cm3; (9)Flash Point: 59.9 °C; (10)Enthalpy of Vaporization: 38.5 kJ/mol; (11)Boiling Point: 148.1 °C at 760 mmHg; (12)Vapour Pressure: 4.3 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)C1=COC=C1
(2)InChI: InChI=1S/C6H6O2/c1-5(7)6-2-3-8-4-6/h2-4H,1H3
(3)InChIKey: GCCKHXWBNPBUOD-UHFFFAOYSA-N