4-Fluorobenzyl chloride

C₇H₆ClFCAS 352-11-4144.57 g/mol

Open in Covalent MOL file

Alkyl halide Aryl 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 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Hazards

Danger

H226 Flammable liquid and vapor19.7% of notifiers
H301 Toxic if swallowed18% of notifiers
H302 Harmful if swallowed14.8% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 61 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P264, P270, P280, P301+P316, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P330, P363, P370+P378, P403+P235, P405, P501

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

Alpha,alpha'-Dichloro-p-xylene623-25-671 % 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 3,5-Difluorobenzyl chloride220141-71-959 % similar 3,4-Difluorobenzyl chloride698-80-658 % similar 4-Chlorobenzyl chloride104-83-655 % similar 1,4-Difluorobenzene540-36-353 % 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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