1-Bromo-4-chloro-2-iodobenzene

C₆H₃BrClICAS 148836-41-3317.35 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₃BrClI
Molar mass: 317.35 g/mol
Exact mass: 315.8151 Da
logP: 3.71Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

148836-41-3

SMILES

C1=CC(=C(C=C1Cl)I)Br

InChIKey

ROJJKFAXAOCLKK-UHFFFAOYSA-N

InChI

InChI=1S/C6H3BrClI/c7-5-2-1-4(8)3-6(5)9/h1-3H

Weigh it out

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

Work with 1-Bromo-4-chloro-2-iodobenzene

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-4-chloro-2-methylbenzene14495-51-357 % similar 1-Bromo-2,4-dichlorobenzene1193-72-256 % similar 1,4-Dichloro-2-iodobenzene29682-41-556 % similar 4-Chloro-2-iodotoluene33184-48-454 % similar 2-Bromo-5-chlorophenol13659-23-952 % similar 1-Bromo-4-chloro-2-fluorobenzene1996-29-852 % similar 1-Bromo-4-fluoro-2-iodobenzene202865-72-352 % similar 2-Bromo-4-chloro-1-methylbenzene27139-97-552 % similar

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

Same formula

1-Bromo-3-chloro-5-iodobenzene13101-40-1 2-Bromo-4-chloro-1-iodobenzene31928-44-6 4-Bromo-2-chloro-1-iodobenzene31928-47-9 1-Bromo-2-chloro-4-iodobenzene535934-25-9

Elsewhere

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