chempirical

4-Bromo-P-terphenyl

C18H13BrCAS 1762-84-1309.21 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 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
1762-84-1
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)Br
InChIKey
XNBGHWRYLJOQAU-UHFFFAOYSA-N
InChI
InChI=1S/C18H13Br/c19-18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-13H

Weigh it out

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

Work with 4-Bromo-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-Bromobiphenyl92-66-0100 % similar 4-Bromo-5′-phenyl-1,1′:3′,1′′-terphenyl116941-52-784 % similar 4,4''-Dibromo-P-terphenyl17788-94-275 % similar 4,4′-Dibromobiphenyl92-86-475 % similar N-(4-Bromophenyl)-[1,1'-biphenyl]-4-amine1160294-93-873 % similar N-(4-Bromophenyl)-N,N-bis(1,1'-biphenyl-4-yl)amine499128-71-173 % similar N,N-Di((1,1'-biphenyl)-4-yl)-4'-bromo-(1,1'-biphenyl)-4-amine728039-63-273 % similar 4,4'-Dibromo-4''-phenyltriphenylamine884530-69-273 % similar

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

Same formula

1-Bromo-3,5-diphenylbenzene103068-20-8 1-Bromo-3-(4-phenylphenyl)benzene1762-87-4 2''-Bromo-[1,1';4',1'']terphenyl3282-24-4 4-Bromo-M-terphenyl54590-37-3

Elsewhere

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