chempirical

Alpha-furil

C10H6O4CAS 492-94-4190.15 g/mol

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Ketone

Properties

Molecular formula
C10H6O4
Molar mass
190.15 g/mol
Exact mass
190.0266 Da
Melting point
164 °C
logP
1.94Crippen estimate
Polar surface area
60.4 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
3

Identifiers

CAS number
492-94-4
SMILES
O=C(C(=O)c1ccco1)c1ccco1
InChIKey
SXPUVBFQXJHYNS-UHFFFAOYSA-N
InChI
InChI=1S/C10H6O4/c11-9(7-3-1-5-13-7)10(12)8-4-2-6-14-8/h1-6H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

18 names · show all
  • 1,2-Ethanedione, 1,2-di-2-furanyl-
  • Furil
  • Ethanedione, di-2-furanyl-
  • 1,2-Di-2-furanyl-1,2-ethanedione
  • Bipyromucyl
  • α-Furil
  • 2,2′-Furil
  • Difuranylglyoxal
  • 1,2-Di(2-furyl)ethanedione
  • NSC 5561
  • 1,2-Di(furan-2-yl)ethane-1,2-dione
  • 1,2-Di-2-furylethane-1,2-dione
  • Di-2-furanylethanedione
  • 1,2-Di(2-furanyl)-1,2-ethanedione
  • 1,2-Bis(furan-2-yl)ethanedione
  • 1,2-Bis(2-furanyl)-1,2-ethanedione
  • 1,2-Bis(2-furyl)ethanedione
  • 1,2-Bis(2-furyl)-1,2-ethanedione

Work with Alpha-furil

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Acetylfuran1192-62-758 % similar 2-Furoyl chloride527-69-558 % similar 2-Furancarboxamide609-38-158 % similar 2-Furoic acid88-14-258 % similar 2-Furancarboxylic acid hydrazide3326-71-454 % similar Methyl 2-thiofuroate13679-61-352 % similar Methyl 2-furoate611-13-252 % similar 1-(2-Furanyl)-1,3-butanedione25790-35-647 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Naphthazarin475-38-7 4-Oxo-4H-1-benzopyran-2-carboxylic acid4940-39-0 Coumarin-3-carboxylic acid531-81-7

Elsewhere

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