1,4-Bis(chloromethyl)tetrafluorobenzene

C₈H₄Cl₂F₄CAS 131803-37-7247.01 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₈H₄Cl₂F₄
Molar mass: 247.01 g/mol
Exact mass: 245.9626 Da
logP: 3.72Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

131803-37-7

SMILES

C(C1=C(C(=C(C(=C1F)F)CCl)F)F)Cl

InChIKey

WEUAASLFNKTIIM-UHFFFAOYSA-N

InChI

InChI=1S/C8H4Cl2F4/c9-1-3-5(11)7(13)4(2-10)8(14)6(3)12/h1-2H2

Weigh it out

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

Names and synonyms

1 names

1,4-Bis(chloromethyl)-2,3,5,6-tetrafluorobenzene

Work with 1,4-Bis(chloromethyl)tetrafluorobenzene

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

(Chloromethyl)pentafluorobenzene653-35-093 % similar Parylene F dimer1785-64-447 % similar 2,6-Difluorobenzyl chloride697-73-443 % similar 2,3,5,6-Tetrafluoro-1,4-benzenedimethanol92339-07-640 % similar Pentafluorobenzyl bromide1765-40-838 % similar Pentafluorobenzyl alcohol440-60-838 % similar Pentamethylbenzyl chloride484-65-138 % similar 2,3-Difluorobenzyl chloride446-57-137 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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