Compound: 2-Acetylfuran
SMILES: O=C(c1occc1)C
InChIKey: IEMMBWWQXVXBEU-UHFFFAOYSA-N
Synonyms: 2-Acetylfuran, 1192-62-7, 1-(furan-2-yl)ethanone, 2-Furyl methyl ketone, Acetylfuran, Ethanone, 1-(2-furanyl)-, 1-(2-Furyl)ethanone, Methyl 2-furyl ketone, Ketone, 2-furyl methyl, 2-Furylethanone, 1-(Furan-2-yl)ethan-1-one, 1-(2-FURANYL)ETHANONE, FEMA No. 3163, Q5ZRP80K02, CHEBI:59983, NSC-4665, NSC-49133, DTXSID0051601, RefChem:85001, DTXCID1030153, 214-757-1, 2-Acetyl furan, 1-Furan-2-yl-ethanone, Furan, 2-acetyl-, 2-acetylfurane, (2-furanyl)-1-ethanone, Furyl methyl ketone, 1-(2-Furanyl)-ethanone, 2-acetyl-furan, MFCD00003242, 80145-44-4, acetyl furan, 2-Acetylfuran; 1-(2-Furyl)ethanone, Ethanone, 1-(furanyl)-, CCRIS 3161, 2-Furyl methyl ketone (natural), NSC 4665, EINECS 214-757-1, NSC 49133, BRN 0107909, UNII-Q5ZRP80K02, AI3-23586, 2-Acetofurone, a-Furyl methyl ketone, methyl-2-furyl ketone, Cefuroxime Impurity 73, 2-Acetylfuran (Standard), 1-(2-Furyl)ethanone #, Epitope ID:136039, 1-(furan-2-yl)-ethanone, SCHEMBL43960, 5-17-09-00381 (Beilstein Handbook Reference), 2-ACETYLFURAN [FHFI], SCHEMBL554579, SCHEMBL855237, 2-Furyl methyl ketone, 99%, 1-(2-Furanyl)ethanone, 9CI, orb3026076, orb3029967, SCHEMBL5481127, SCHEMBL10802883, FEMA 3163, NSC4665, Fr14542, HY-W015912R, NSC49133, STR05504, 2-FURYL METHYL KETONE [FCC], SBB040248, STK400329, 1-(2-furanyl)ethanone (acetylfuran), AKOS000119584, MSK1693-1000M, 2-Furyl methyl ketone, >=99%, FG, CS-W016628, EBC-536078, FA02198, HY-W015912, PS-4586, SB60920, 2-Acetyl furan; 2-Furyl methyl ketone, 1-(2-Furanyl)-ethanone (2-acetylfuran), AC-11853, PD158331, 2-Furyl methyl ketone, analytical standard, DB-003253, A0091, NS00012490, ST50213408, EN300-20230, 2-Acetylfuran Solution in Methanol, 1000ug/mL, 2-Furyl methyl ketone, purum, >=99.0% (GC), F088461, 2-Furyl methyl ketone, natural (US), >=97%, FG, Q15634156, F0001-0316, 2-Aminomethyl-azetidine-1-carboxylic acid tert-butylester, InChI=1/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H
Theoretical properties:
molecular_formula: C6H6O2
molecular_weight: 110.11 g/mol
exact_mass: 110.036779430 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 1
heavy_atom_count: 8
topological_polar_surface_area: 30.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
boiling_point: 67.00 °C. @ 10.00 mm Hg
melting_point: 33 °C
density: 1.102-1.107
solubility: Very slightly soluble in water; Slightly soluble in propylene glycol, vegetable oils
Descriptions:
pubchem: 2-acetylfuran is a furan carrying an acetyl substituent at the 2-position. Used in the production of the antibiotic cefuroxime (CHEBI:3515). It is a member of furans, a methyl ketone and an aromatic ketone.
chebi: A furan carrying an acetyl substituent at the 2-position. Used in the production of the antibiotic cefuroxime (CHEBI:3515).
wikipedia: 2-Acetylfuran has a low melting point and a high boiling point. The solid melts at 30 °C and has a density of 1.0975 g/ml at 20 °C, while the normal boiling point of the liquid is 168–169 °C. 2-Acetylfuran is a useful intermediate in the synthesis of fine chemicals and pharmaceuticals, and is used in the production of the generic cephalophosphorin antibiotic cefuroxime.