6-Bromonaphthalen-2-amine hydrochloride

C₁₀H₉BrClNCAS 71590-31-3258.54 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₁₀H₉BrClN
Molar mass: 258.54 g/mol
Exact mass: 256.9607 Da
logP: 3.61Crippen 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

71590-31-3

SMILES

C1=CC2=C(C=CC(=C2)Br)C=C1N.Cl

InChIKey

PIUVTVGJKFGBJL-UHFFFAOYSA-N

InChI

InChI=1S/C10H8BrN.ClH/c11-9-3-1-8-6-10(12)4-2-7(8)5-9;/h1-6H,12H2;1H

Weigh it out

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

Work with 6-Bromonaphthalen-2-amine hydrochloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

6-Bromonaphthalen-2-amine7499-66-3Free base

Similar compounds

2,6-Dibromonaphthalene13720-06-458 % similar 2,6-Dibromoanthracene186517-01-154 % similar Anthracene-2,6-diamine46710-42-354 % similar 4-Bromoaniline106-40-150 % similar 2-Bromonaphthalene580-13-250 % similar 2,7-Dibromonaphthalene58556-75-550 % similar 2-Naphthylamine91-59-850 % similar 3-Bromoaniline591-19-548 % similar

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

Elsewhere

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