chempirical

1,6-Dibromo-2-naphthalenol

C10H6Br2OCAS 16239-18-2301.96 g/mol

Open in Covalent MOL file
HOBrBr
Aryl halidePhenol

Properties

Molecular formula
C10H6Br2O
Molar mass
301.96 g/mol
Exact mass
299.8785 Da
Melting point
106 °C
logP
4.07Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
16239-18-2
SMILES
Oc1ccc2cc(Br)ccc2c1Br
InChIKey
VKESFYLPKHQOOA-UHFFFAOYSA-N
InChI
InChI=1S/C10H6Br2O/c11-7-2-3-8-6(5-7)1-4-9(13)10(8)12/h1-5,13H

Weigh it out

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

Names and synonyms

7 names
  • 2-Naphthalenol, 1,6-dibromo-
  • 2-Naphthol, 1,6-dibromo-
  • 1,6-Dibromo-β-naphthol
  • 1,6-Dibromo-2-naphthol
  • 1,6-Dibromo-2-hydroxynaphthalene
  • 2-Hydroxy-1,6-dibromonaphthalene
  • NSC 9870

Work with 1,6-Dibromo-2-naphthalenol

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

(S)-(+)-6,6'-Dibromo-1,1'-bi-2-naphthol13185-00-770 % similar 1-Bromo-2-hydroxynaphthalene573-97-758 % similar 4-Bromocatechol17345-77-652 % similar 2,4-Dibromophenol615-58-748 % similar 2-Bromo-7-hydroxynaphthalene116230-30-947 % similar 4-Bromo-2-chlorophenol3964-56-547 % similar 4-Bromo-2-fluorophenol2105-94-445 % similar 4-Bromo-2-methylphenol2362-12-145 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook