2,4-Dibromobiphenyl

C₁₂H₈Br₂CAS 53592-10-2312.00 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₈Br₂
Molar mass: 312.00 g/mol
Exact mass: 309.8993 Da
logP: 4.88Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

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

53592-10-2

SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)Br)Br

InChIKey

BWVLLEHUUJBZMR-UHFFFAOYSA-N

InChI

InChI=1S/C12H8Br2/c13-10-6-7-11(12(14)8-10)9-4-2-1-3-5-9/h1-8H

Weigh it out

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

Work with 2,4-Dibromobiphenyl

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

2-Bromobiphenyl2052-07-560 % similar 4-Bromo-2-fluoro-1,1′-biphenyl41604-19-760 % similar 2''-Bromo-[1,1';4',1'']terphenyl3282-24-456 % similar 4-Bromo-5′-phenyl-1,1′:3′,1′′-terphenyl116941-52-750 % similar 4-Bromo-P-terphenyl1762-84-150 % similar 3-Bromobiphenyl2113-57-750 % similar 1-Bromo-4-phenylnaphthalene59951-65-450 % similar 1,2,4-Tribromobenzene615-54-350 % similar

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

Same formula

2,2'-Dibromobiphenyl13029-09-9 3,5-Dibromobiphenyl16372-96-6 4,4′-Dibromobiphenyl92-86-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook