chempirical

4-Fluorobenzyl chloride

C7H6ClFCAS 352-11-4144.57 g/mol

Open in Covalent MOL file
FCl
Alkyl halideAryl halide

Properties

Molecular formula
C7H6ClF
Molar mass
144.57 g/mol
Exact mass
144.0142 Da
Density
1.2095 g/mL (at 20 °C)
Melting point
44.5–45.5 °C
Boiling point
82 °C
logP
2.56Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
352-11-4
SMILES
Fc1ccc(CCl)cc1
InChIKey
IZXWCDITFDNEBY-UHFFFAOYSA-N
InChI
InChI=1S/C7H6ClF/c8-5-6-1-3-7(9)4-2-6/h1-4H,5H2

Weigh it out

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

Names and synonyms

9 names
  • Benzene, 1-(chloromethyl)-4-fluoro-
  • Toluene, α-chloro-p-fluoro-
  • 1-(Chloromethyl)-4-fluorobenzene
  • p-Fluorobenzyl chloride
  • α-Chloro-4-fluorotoluene
  • α-Chloro-p-fluorotoluene
  • 4-Fluorophenylmethyl chloride
  • NSC 25084
  • 4-Fluoro-1-(chloromethyl)benzene

Work with 4-Fluorobenzyl chloride

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Xylylene dichloride623-25-671 % similar 1-(2-Chloroethyl)-4-fluorobenzene332-43-464 % similar 4,4′-Bis(chloromethyl)biphenyl1667-10-360 % similar 1,1′-Methylenebis[4-fluorobenzene]457-68-160 % similar 4-Chlorobenzyl chloride104-83-655 % similar 1,4-Difluorobenzene540-36-353 % similar Benzyl chloride100-44-752 % similar 4-Methylbenzyl chloride104-82-552 % similar

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

Same formula

2-Chloro-1-fluoro-4-methylbenzene1513-25-3 1-Chloro-4-fluoro-2-methylbenzene33406-96-1 2-Fluorobenzyl chloride345-35-7 2-Chloro-6-fluorotoluene443-83-4 4-Chloro-1-fluoro-2-methylbenzene452-66-4 2-Chloro-4-fluoro-1-methylbenzene452-73-3 4-Chloro-2-fluoro-1-methylbenzene452-75-5 3-Fluorobenzyl chloride456-42-8

Elsewhere

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