chempirical

4-Chloro-3-(trifluoromethyl)benzyl alcohol

C8H6ClF3OCAS 65735-71-9210.58 g/mol

Open in Covalent MOL file
HOFFFCl
AlcoholAlkyl halideAryl halide

Properties

Molecular formula
C8H6ClF3O
Molar mass
210.58 g/mol
Exact mass
210.0059 Da
logP
2.85Crippen 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
65735-71-9
SMILES
C1=CC(=C(C=C1CO)C(F)(F)F)Cl
InChIKey
JRYCPYROZOWIDJ-UHFFFAOYSA-N
InChI
InChI=1S/C8H6ClF3O/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-3,13H,4H2

Weigh it out

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Work with 4-Chloro-3-(trifluoromethyl)benzyl 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

4-Chloro-3-(trifluoromethyl)benzyl bromide261763-23-965 % similar 4-Chloro-3-(trifluoromethyl)benzylamine62039-92-365 % similar 4-Fluoro-3-(trifluoromethyl)benzyl alcohol67515-61-162 % similar 3,4-Dichlorobenzenemethanol1805-32-958 % similar 4-Chloro-3-(trifluoromethyl)phenol6294-93-556 % similar 1,4-Dichloro-2-(trifluoromethyl)benzene320-50-355 % similar 2,4-Bis(trifluoromethyl)chlorobenzene327-76-455 % similar 1-Chloro-4-fluoro-2-(trifluoromethyl)benzene89634-75-353 % similar

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

Same formula

2-Chloro-3-(trifluoromethyl)benzyl alcohol261763-20-6 [5-Chloro-2-(trifluoromethyl)phenyl]methanol261763-21-7 4-Chloro-3-(trifluoromethyl)anisole400-73-7 2-Chloro-4-(trifluoromethyl)benzenemethanol56456-51-0 2-Chloro-5-(trifluoromethyl)benzyl alcohol64372-62-9 4-(Trifluoromethoxy)benzyl chloride65796-00-1

Elsewhere

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