1-(Bromomethyl)-2,3,4-trifluorobenzene

C₇H₄BrF₃CAS 157911-55-2225.01 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₇H₄BrF₃
Molar mass: 225.01 g/mol
Exact mass: 223.9448 Da
logP: 3.00Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Identifiers

CAS number

157911-55-2

SMILES

C1=CC(=C(C(=C1CBr)F)F)F

InChIKey

DGSXDQVPGXFOAN-UHFFFAOYSA-N

InChI

InChI=1S/C7H4BrF3/c8-3-4-1-2-5(9)7(11)6(4)10/h1-2H,3H2

Weigh it out

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

Names and synonyms

1 names

2,3,4-Trifluorobenzyl bromide

Work with 1-(Bromomethyl)-2,3,4-trifluorobenzene

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-Difluorobenzyl bromide113211-94-269 % similar 1,2,3,4-Tetrafluorobenzene551-62-255 % similar 1-Bromo-3-(bromomethyl)-2-fluorobenzene149947-16-050 % similar 2,4-Difluorobenzyl bromide23915-07-350 % similar 2-Fluorobenzyl bromide446-48-050 % similar 2,5-Difluorobenzyl bromide85117-99-350 % similar 4-Bromo-2-fluorobenzyl bromide76283-09-548 % similar 4-Chloro-2-fluorobenzyl bromide71916-82-047 % similar

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

Same formula

2,4,6-Trifluorobenzyl bromide151411-98-2 2,3,6-Trifluorobenzyl bromide151412-02-1 2,4,5-Trifluorobenzyl bromide157911-56-3 3,4,5-Trifluorobenzyl bromide220141-72-0 1-Bromo-2-(trifluoromethyl)benzene392-83-6 1-Bromo-3-(trifluoromethyl)benzene401-78-5 1-Bromo-4-(trifluoromethyl)benzene402-43-7

Elsewhere

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