chempirical

2-Fluoro-2-deoxy-D-glucose

C6H11FO5CAS 29702-43-0182.15 g/mol

Open in Covalent MOL file
OFOHOHOHOH
AlcoholAldehydeAlkyl halide

Properties

Molecular formula
C6H11FO5
Molar mass
182.15 g/mol
Exact mass
182.0591 Da
Melting point
170–176 °C
logP
-2.40Crippen estimate
Polar surface area
98.0 Ų
H-bond donors / acceptors
4 / 5
Rotatable bonds
5
Stereocentres
R, S, R, Rin SMILES atom order

Identifiers

CAS number
29702-43-0
SMILES
O=C[C@H](F)[C@@H](O)[C@H](O)[C@H](O)CO
InChIKey
AOYNUTHNTBLRMT-SLPGGIOYSA-N
InChI
InChI=1S/C6H11FO5/c7-3(1-8)5(11)6(12)4(10)2-9/h1,3-6,9-12H,2H2/t3-,4+,5+,6+/m0/s1

Weigh it out

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

Names and synonyms

8 names
  • D-Glucose, 2-deoxy-2-fluoro-
  • 2-Deoxy-2-fluoro-D-glucose
  • 2-Fluorodeoxyglucose
  • 2-Deoxy-2-fluoroglucose
  • Fluorodeoxyglucose
  • FDG
  • 2-Deoxy-2-fluoro-D-glucopyranose
  • 2-Fluoro-2-deoxy-d-glucopyranose

Work with 2-Fluoro-2-deoxy-D-glucose

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

Glucosamine3416-24-865 % similar L-Mannose10030-80-563 % similar L-Galactose15572-79-963 % similar Altrose1990-29-063 % similar L-Talose23567-25-163 % similar Allose2595-97-363 % similar Talose2595-98-463 % similar Glucose50-99-763 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook