3-Bromo-9-phenylcarbazole

C₁₈H₁₂BrNCAS 1153-85-1322.21 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₈H₁₂BrN
Molar mass: 322.21 g/mol
Exact mass: 321.0153 Da
logP: 5.55Crippen estimate
Polar surface area: 4.9 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation50% of notifiers
H332 Harmful if inhaled50% of notifiers

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, P317, P321, P330, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

1153-85-1

SMILES

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)Br)C4=CC=CC=C42

InChIKey

KUBSCXXKQGDPPD-UHFFFAOYSA-N

InChI

InChI=1S/C18H12BrN/c19-13-10-11-18-16(12-13)15-8-4-5-9-17(15)20(18)14-6-2-1-3-7-14/h1-12H

Weigh it out

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

Work with 3-Bromo-9-phenylcarbazole

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

3,6-Dibromo-9-phenylcarbazole57103-20-589 % similar 9-(4-Biphenylyl)-3-bromocarbazole894791-46-982 % similar 9-([1,1'-Biphenyl]-3-yl)-3-bromo-9H-carbazole1428551-28-377 % similar 3-(4-Bromophenyl)-9-phenylcarbazole1028647-93-976 % similar 3-Bromo-6,9-diphenyl-9H-carbazole1160294-85-874 % similar 2,7-Dibromo-N-phenylcarbazole444796-09-271 % similar 9-(1,1-Bipheny)-4-yl-3-(4-bromophenyl)carbazole1028648-25-069 % similar 3-Bromo-9-(2-naphthyl)carbazole934545-80-969 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromo-9-phenyl-9H-carbazole1097884-37-1 1-Bromo-9-phenyl-9H-carbazole1333002-37-1 9-(3-Bromophenyl)carbazole185112-61-2 9-(4-Bromophenyl)carbazole57102-42-8 N-(2-Bromophenyl)-9H-carbazole902518-11-0 2-Bromo-9-phenylcarbazole94994-62-4

Elsewhere

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