2,3-Difluorobenzyl bromide

C₇H₅BrF₂CAS 113211-94-2207.02 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₇H₅BrF₂
Molar mass: 207.02 g/mol
Exact mass: 205.9543 Da
logP: 2.86Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Identifiers

CAS number

113211-94-2

SMILES

C1=CC(=C(C(=C1)F)F)CBr

InChIKey

FTBSGSZZESQDBM-UHFFFAOYSA-N

InChI

InChI=1S/C7H5BrF2/c8-4-5-2-1-3-6(9)7(5)10/h1-3H,4H2

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Names and synonyms

1 names

1-(Bromomethyl)-2,3-difluoro-benzene

Work with 2,3-Difluorobenzyl bromide

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-Fluorobenzyl bromide446-48-068 % similar 1-Bromo-3-(bromomethyl)-2-fluorobenzene149947-16-067 % similar 2-Bromo-1-(bromomethyl)-3-fluorobenzene1184918-22-664 % similar 2,3-Difluorobenzyl alcohol75853-18-861 % similar 1-(Bromomethyl)-2-fluoro-3-(trifluoromethyl)benzene184970-25-058 % similar 2,3-Difluorobenzeneacetonitrile145689-34-555 % similar 1-Bromo-2,3-difluorobenzene38573-88-552 % similar 2,3-Difluorobenzeneacetic acid145689-41-450 % similar

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

Same formula

2,4-Difluorobenzyl bromide23915-07-3 2,5-Difluorobenzyl bromide85117-99-3 2,6-Difluorobenzyl bromide85118-00-9 3,4-Difluorobenzyl bromide85118-01-0 1-Bromo-4,5-difluoro-2-methylbenzene875664-38-3

Elsewhere

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