1,3-Dibromo-2-chlorobenzene

C₆H₃Br₂ClCAS 19230-27-4270.35 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₃Br₂Cl
Molar mass: 270.35 g/mol
Exact mass: 267.8290 Da
logP: 3.87Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed95% of notifiers
H413 May cause long lasting harmful effects to aquatic life95% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P501

Identifiers

CAS number

19230-27-4

SMILES

C1=CC(=C(C(=C1)Br)Cl)Br

InChIKey

IRPWVEBIMPXCAZ-UHFFFAOYSA-N

InChI

InChI=1S/C6H3Br2Cl/c7-4-2-1-3-5(8)6(4)9/h1-3H

Weigh it out

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Work with 1,3-Dibromo-2-chlorobenzene

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-Bromo-2,3-dichlorobenzene56961-77-468 % similar 3-Bromo-2-chlorophenol863870-87-562 % similar 1-Bromo-2-chloro-3-fluorobenzene883499-24-962 % similar 3,5-Dibromo-4-chloropyridine13626-17-055 % similar 1-Bromo-2-chloro-3-(trifluoromethyl)benzene56131-47-654 % similar 4-Bromo-2,3-dichlorobenzenamine56978-48-452 % similar 1,3-Dibromo-2-chloro-5-fluorobenzene179897-90-650 % similar 4-Chloro-3,5-dibromotoluene202925-05-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,3-Dibromo-5-chlorobenzene14862-52-3 1,4-Dibromo-2-chlorobenzene3460-24-0

Elsewhere

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