3-Chloro-2,6-dibromo-4-fluoroaniline

C₆H₃Br₂ClFNCAS 175135-09-8303.35 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₃Br₂ClFN
Molar mass: 303.35 g/mol
Exact mass: 300.8305 Da
logP: 3.59Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
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

175135-09-8

SMILES

C1=C(C(=C(C(=C1Br)N)Br)Cl)F

InChIKey

PRZBEZGEEPNKRO-UHFFFAOYSA-N

InChI

InChI=1S/C6H3Br2ClFN/c7-2-1-3(10)5(9)4(8)6(2)11/h1H,11H2

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Work with 3-Chloro-2,6-dibromo-4-fluoroaniline

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

3-Chloro-2,6-dibromo-4-methylaniline84483-22-759 % similar 2-Bromo-4-chloro-6-fluorobenzenamine195191-47-053 % similar 6-Bromo-2,3,4-trifluorobenzenamine122375-82-052 % similar 4,6-Dibromo-2,3-dichloroaniline113571-15-650 % similar 2,4-Dibromo-6-fluoroaniline141474-37-547 % similar 1-Bromo-2,5-dichloro-3-fluorobenzene202865-57-447 % similar 1,5-Dibromo-2-chloro-3-fluorobenzene202925-04-047 % similar 2-Bromo-4,6-difluorobenzenamine444-14-447 % similar

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

Elsewhere

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