chempirical

4,4''-Dibromo-P-terphenyl

C18H12Br2CAS 17788-94-2388.10 g/mol

Open in Covalent MOL file
BrBr
Aryl halide

Properties

Molecular formula
C18H12Br2
Molar mass
388.10 g/mol
Exact mass
385.9306 Da
logP
6.55Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Identifiers

CAS number
17788-94-2
SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br
InChIKey
VAIPJQIPFPRJKJ-UHFFFAOYSA-N
InChI
InChI=1S/C18H12Br2/c19-17-9-5-15(6-10-17)13-1-2-14(4-3-13)16-7-11-18(20)12-8-16/h1-12H

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Work with 4,4''-Dibromo-P-terphenyl

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

4,4′-Dibromobiphenyl92-86-4100 % similar 1,4-Dibromobenzene106-37-675 % similar 4-Bromo-P-terphenyl1762-84-175 % similar 4-Bromobiphenyl92-66-075 % similar 4-Bromo-4′-hydroxybiphenyl29558-77-871 % similar 4-Bromo-4'-iodobiphenyl105946-82-567 % similar 4-(4-Bromophenyl)pyridine39795-60-367 % similar 4-Bromo-4′-fluoro-1,1′-biphenyl398-21-067 % similar

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

Elsewhere

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