4-Bromo-M-terphenyl

C18H13BrCAS 54590-37-3309.21 g/mol

Open in Covalent MOL file
Br
Aryl halide

Properties

Molecular formula
C18H13Br
Molar mass
309.21 g/mol
Exact mass
308.0201 Da
logP
5.78Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
54590-37-3
SMILES
C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=C(C=C3)Br
InChIKey
XWHCOAVJEOENNM-UHFFFAOYSA-N
InChI
InChI=1S/C18H13Br/c19-18-11-9-15(10-12-18)17-8-4-7-16(13-17)14-5-2-1-3-6-14/h1-13H

Weigh it out

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

Work with 4-Bromo-M-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-Bromo-5′-phenyl-1,1′:3′,1′′-terphenyl116941-52-786 % similar 4-Bromobiphenyl92-66-080 % similar 3-Bromobiphenyl2113-57-770 % similar 1,3,5-Tris(4-bromophenyl)benzene7511-49-167 % similar M-Terphenyl92-06-865 % similar N-(4-Bromophenyl)-[1,1'-biphenyl]-4-amine1160294-93-862 % similar 2-(4-Bromophenyl)naphthalene22082-99-162 % similar N-(4-Bromophenyl)-N,N-bis(1,1'-biphenyl-4-yl)amine499128-71-162 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Bromo-3,5-diphenylbenzene103068-20-8 4-Bromo-P-terphenyl1762-84-1 1-Bromo-3-(4-phenylphenyl)benzene1762-87-4 2''-Bromo-[1,1';4',1'']terphenyl3282-24-4

Elsewhere

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