chempirical

9-(3-Bromophenyl)carbazole

C18H12BrNCAS 185112-61-2322.20 g/mol

Open in Covalent MOL file
NBr
Aryl halide

Properties

Molecular formula
C18H12BrN
Molar mass
322.20 g/mol
Exact mass
321.0153 Da
logP
5.55Crippen estimate
Polar surface area
4.9 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number
185112-61-2
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC(=CC=C4)Br
InChIKey
ZKGHGKNHPPZALY-UHFFFAOYSA-N
InChI
InChI=1S/C18H12BrN/c19-13-6-5-7-14(12-13)20-17-10-3-1-8-15(17)16-9-2-4-11-18(16)20/h1-12H

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Work with 9-(3-Bromophenyl)carbazole

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

9,9'-(5-Bromo-1,3-phenylene)bis(9H-carbazole)750573-24-172 % similar 9-(3,5-Dibromophenyl)-9H-carbazole750573-26-372 % similar 9,9'-(1,3-Phenylene)bis-9H-carbazole550378-78-470 % similar 2-(3-Bromophenyl)-9H-bromophenylcarbazole1365118-41-767 % similar 9-([1,1'-Biphenyl]-3-yl)-3-bromo-9H-carbazole1428551-28-367 % similar 3-Bromo-9-(2-naphthyl)carbazole934545-80-959 % similar 9-([1,1'-Biphenyl]-3-yl)-9H-carbazole1221237-87-159 % similar 2,7-Dibromo-N-phenylcarbazole444796-09-259 % similar

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

Same formula

4-Bromo-9-phenyl-9H-carbazole1097884-37-1 3-Bromo-9-phenylcarbazole1153-85-1 1-Bromo-9-phenyl-9H-carbazole1333002-37-1 9-(4-Bromophenyl)carbazole57102-42-8 N-(2-Bromophenyl)-9H-carbazole902518-11-0 2-Bromo-9-phenylcarbazole94994-62-4

Elsewhere

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