1-(3-Bromophenyl)-1H-pyrrole

C10H8BrNCAS 107302-22-7222.08 g/mol

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NBr
Aryl halide

Properties

Molecular formula
C10H8BrN
Molar mass
222.08 g/mol
Exact mass
220.9840 Da
logP
3.24Crippen estimate
Polar surface area
4.9 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
107302-22-7
SMILES
C1=CN(C=C1)C2=CC(=CC=C2)Br
InChIKey
LEUXOIBRUWVBGM-UHFFFAOYSA-N
InChI
InChI=1S/C10H8BrN/c11-9-4-3-5-10(8-9)12-6-1-2-7-12/h1-8H

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Work with 1-(3-Bromophenyl)-1H-pyrrole

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

1,3-Dibromobenzene108-36-152 % similar 3-(1H-Pyrrol-1-yl)aniline89353-42-452 % similar 9-(3-Bromophenyl)carbazole185112-61-250 % similar 1-Phenylpyrrole635-90-548 % similar 3,3''-Dibromo-1,1':3',1''-terphenyl95962-62-244 % similar 1-Bromo-3-fluorobenzene1073-06-943 % similar 1-Bromo-3-chlorobenzene108-37-243 % similar 1,3,5-Tris(3-bromophenyl)benzene96761-85-243 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-(4-Bromophenyl)cyclopropanecarbonitrile124276-67-1 1-Bromonaphthalen-2-amine20191-75-7 1-Amino-4-bromonaphthalene2298-07-9 6-Bromo-4-methylquinoline41037-28-9 5-Bromonaphthalen-1-amine4766-33-0 2-(Bromomethyl)quinoline5632-15-5 8-Bromo-2-methyl-quinoline61047-43-6 8-Bromo-1-naphthalenamine62456-34-2

Elsewhere

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