3-Bromo-1H-pyrrolo[2,3-C]pyridine

C7H5BrN2CAS 67058-76-8197.03 g/mol

Open in Covalent MOL file
NHNBr
Aryl halide

Properties

Molecular formula
C7H5BrN2
Molar mass
197.03 g/mol
Exact mass
195.9636 Da
logP
2.33Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

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

Identifiers

CAS number
67058-76-8
SMILES
C1=CN=CC2=C1C(=CN2)Br
InChIKey
DAGAQTLMZAEUKX-UHFFFAOYSA-N
InChI
InChI=1S/C7H5BrN2/c8-6-3-10-7-4-9-2-1-5(6)7/h1-4,10H

Weigh it out

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Work with 3-Bromo-1H-pyrrolo[2,3-C]pyridine

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-Bromoindole1484-27-153 % similar 4-Bromo-1H-pyrrolo(2,3-c)pyridine69872-17-953 % similar 1H-Pyrrolo(2,3-c)pyridine-3-carbaldehyde25957-65-751 % similar 5,8-Dibromoisoquinoline81045-39-850 % similar 1H-Pyrrolo(2,3-c)pyridine-3-carboxylic acid67058-74-647 % similar 5-Bromoisoquinoline34784-04-845 % similar 3,4-Dibromopyridine13534-90-245 % similar 5-Bromo-7H-pyrrolo[2,3-D]pyrimidine175791-49-843 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-4-azaindole1000341-51-4 2-Bromo-5-cyano-4-picoline1003711-35-0 5-Bromopyrazolo[1,5-A]pyridine1060812-84-1 2-Amino-3-bromobenzonitrile114344-60-4 5-Bromo-1H-pyrrolo[2,3-c]pyridine1215387-58-8 6-Bromopyrazolo(1,5-a)pyridine1264193-11-4 6-Bromo-1H-pyrrolo[2,3-B]pyridine143468-13-7 5-Bromo-3-methylpyridine-2-carbonitrile156072-86-5

Elsewhere

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