4-Methyl-2,3,5,6-tetrafluorobenzyl alcohol

C8H6F4OCAS 79538-03-7194.13 g/mol

Open in Covalent MOL file
FFOHFF
AlcoholAryl halide

Properties

Molecular formula
C8H6F4O
Molar mass
194.13 g/mol
Exact mass
194.0355 Da
Melting point
50–51 °C
logP
2.04Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Search the SDS library

Identifiers

CAS number
79538-03-7
SMILES
Cc1c(F)c(F)c(CO)c(F)c1F
InChIKey
PJCSTULKVNHEGW-UHFFFAOYSA-N
InChI
InChI=1S/C8H6F4O/c1-3-5(9)7(11)4(2-13)8(12)6(3)10/h13H,2H2,1H3

Weigh it out

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

Names and synonyms

3 names
  • Benzenemethanol, 2,3,5,6-tetrafluoro-4-methyl-
  • 2,3,5,6-Tetrafluoro-4-methylbenzenemethanol
  • 2,3,5,6-Tetrafluoro-4-methylbenzyl alcohol

Work with 4-Methyl-2,3,5,6-tetrafluorobenzyl 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

2,3,5,6-Tetrafluoro-1,4-benzenedimethanol92339-07-670 % similar Pentafluorobenzyl alcohol440-60-867 % similar 2,3,5,6-Tetrafluoro-P-xylene703-87-755 % similar 1-Bromomethyl-4-methyl-2,3,5,6-tetrafluorobenzene92814-00-154 % similar 4-Methoxymethyl-2,3,5,6-tetrafluorobenzyl alcohol83282-91-154 % similar Pentafluoromethylbenzene771-56-252 % similar 2,3,4,5,6-Pentamethylbenzenemethanol484-66-252 % similar 2,3,5,6-Tetrafluorobenzyl alcohol4084-38-248 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Fluoro-3-(trifluoromethyl)anisole127271-65-2 2-Fluoro-6-(trifluoromethyl)benzyl alcohol152211-15-9 3-Fluoro-5-(trifluoromethyl)benzyl alcohol184970-29-4 2-Fluoro-4-(trifluoromethyl)benzyl alcohol197239-49-9 2-Fluoro-5-(trifluoromethyl)benzyl alcohol207974-09-2 2-Fluoro-3-(trifluoromethyl)benzyl alcohol207981-45-1 4-Fluoro-2-(trifluoromethyl)benzyl alcohol220227-29-2 5-Fluoro-2-(trifluoromethyl)benzenemethanol238742-82-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook