chempirical

Furfuryl alcohol

C5H6O2CAS 98-00-098.10 g/mol

Open in Covalent MOL file
HOO
Alcohol

Properties

Molecular formula
C5H6O2
Molar mass
98.10 g/mol
Exact mass
98.0368 Da
Density
1.1296 g/mL (at 20 °C)
Melting point
−15 °C
Boiling point
171 °C (at 750 Torr)
logP
0.77Crippen estimate
Polar surface area
33.4 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
98-00-0
SMILES
OCc1ccco1
InChIKey
XPFVYQJUAUNWIW-UHFFFAOYSA-N
InChI
InChI=1S/C5H6O2/c6-4-5-2-1-3-7-5/h1-3,6H,4H2

Weigh it out

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

Names and synonyms

17 names · show all
  • 2-Furanmethanol
  • 2-Furylmethanol
  • 2-Furanylmethanol
  • Chem-rez 200
  • Furfuranol
  • NSC 8843
  • 2-Furylmethyl alcohol
  • Chem-rez fury 454
  • 2-Furancarbinol
  • Furfuralcohol
  • α-Furylcarbinol
  • 2-Furylcarbinol
  • Furylcarbinol
  • 2-Furfuryl alcohol
  • 2-(Hydroxymethyl)furan
  • 5-Hydroxymethylfuran
  • α-Furfuryl alcohol

Work with Furfuryl alcohol

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

Difurfuryl sulfide13678-67-652 % similar 2-Ethylfuran3208-16-052 % similar Difurfuryl disulfide4437-20-152 % similar 2-Furanmethanamine617-89-052 % similar Furan-2-ylmethanethiol98-02-252 % similar 2-Propylfuran4229-91-848 % similar 2,5-Bis(hydroxymethyl)furan1883-75-648 % similar 2-[(Methylthio)methyl]furan1438-91-146 % similar

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

Same formula

2-Methoxyfuran25414-22-6 1,3-Cyclopentanedione3859-41-4 3-Furanmethanol4412-91-3 Tulipalin A547-65-9 α-Angelica lactone591-12-8 4-Pentynoic acid6089-09-4 Ethyl propiolate623-47-2 2,4-Pentadienoic acid626-99-3

Elsewhere

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