1,2,5-Tribromo-3-fluorobenzene

C₆H₂Br₃FCAS 2839-37-4332.79 g/mol

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Properties

Molecular formula: C₆H₂Br₃F
Molar mass: 332.79 g/mol
Exact mass: 329.7691 Da
Melting point: 41 °C
logP: 4.11Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

2839-37-4

SMILES

Fc1cc(Br)cc(Br)c1Br

InChIKey

JPASTFJJLHVUFF-UHFFFAOYSA-N

InChI

InChI=1S/C6H2Br3F/c7-3-1-4(8)6(9)5(10)2-3/h1-2H

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Names and synonyms

1 names

Benzene, 1,2,5-tribromo-3-fluoro-

Work with 1,2,5-Tribromo-3-fluorobenzene

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

1,4-Dibromo-3,5-difluorobenzene128259-71-273 % similar 1,2-Dibromo-3,5-difluorobenzene139215-43-362 % similar 5-Bromo-1,2,3-trifluorobenzene138526-69-958 % similar 2,4-Dibromo-6-fluoroaniline141474-37-557 % similar 1,5-Dibromo-2-chloro-3-fluorobenzene202925-04-057 % similar 1,2-Dibromo-5-chloro-3-fluorobenzene208186-78-157 % similar 2,4-Dibromo-6-fluorophenol576-86-357 % similar 2,4-Dibromo-1-fluorobenzene1435-53-652 % similar

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

Same formula

1,2,3-Tribromo-5-fluorobenzene576-82-9

Elsewhere

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