chempirical

3,3-Difluorocyclobutanol

C4H6F2OCAS 637031-88-0108.09 g/mol

Open in Covalent MOL file
HOFF
AlcoholAlkyl halide

Properties

Molecular formula
C4H6F2O
Molar mass
108.09 g/mol
Exact mass
108.0387 Da
logP
0.78Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
637031-88-0
SMILES
OC1CC(F)(F)C1
InChIKey
BFLCYDVYEGKWSQ-UHFFFAOYSA-N
InChI
InChI=1S/C4H6F2O/c5-4(6)1-3(7)2-4/h3,7H,1-2H2

Weigh it out

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

Names and synonyms

2 names
  • Cyclobutanol, 3,3-difluoro-
  • 3,3-Difluorocyclobutan-1-ol

Work with 3,3-Difluorocyclobutanol

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

3,3-Difluorocyclobutanecarboxylic acid107496-54-838 % similar 4-Hydroxy-2,2,6,6-tetramethylpiperidine2403-88-538 % similar 1,3-Difluoro-2-propanol453-13-435 % similar 1,2,2,6,6-Pentamethyl-4-piperidinol2403-89-635 % similar 1,4-Dihydroxy-2,2,6,6-tetramethylpiperidine3637-10-335 % similar Cyclopropanol16545-68-933 % similar 1,3,5-Cyclohexanetriol2041-15-833 % similar 4-Hydroxy-tempo2226-96-233 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook