chempirical

2-Furoic acid

C5H4O3CAS 88-14-2112.08 g/mol

Open in Covalent MOL file
OHOO
Carboxylic acid

Properties

Molecular formula
C5H4O3
Molar mass
112.08 g/mol
Exact mass
112.0160 Da
Density
1.48 g/mL
Melting point
133.5 °C
Boiling point
231 °C
logP
0.98Crippen estimate
Polar surface area
50.4 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
88-14-2
SMILES
O=C(O)c1ccco1
InChIKey
SMNDYUVBFMFKNZ-UHFFFAOYSA-N
InChI
InChI=1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)

Weigh it out

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

Names and synonyms

9 names
  • 2-Furancarboxylic acid
  • α-Furancarboxylic acid
  • α-Furoic acid
  • Pyromucic acid
  • 2-Carboxyfuran
  • 2-Furanoic acid
  • NSC 58965
  • NSC 8842
  • Furan-2-carboxylic acid

Reactions

Work with 2-Furoic acid

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Alpha-furil492-94-458 % similar 2,5-Furandicarboxylic acid3238-40-254 % similar 2-Acetylfuran1192-62-752 % similar 2-Furoyl chloride527-69-552 % similar 2-Furancarboxamide609-38-152 % similar Phthalic acid88-99-350 % similar 2-Furancarboxylic acid hydrazide3326-71-448 % similar 1-(2-Furanyl)-1,3-butanedione25790-35-647 % similar

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

Same formula

Itaconic anhydride2170-03-8 3-Furancarboxylic acid488-93-7 3-Hydroxy-4-pyrone496-63-9 Citraconic anhydride616-02-4

Elsewhere

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