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

C₁₀H₈BrNCAS 107302-22-7222.08 g/mol

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Properties

Molecular formula: C₁₀H₈BrN
Molar mass: 222.08 g/mol
Exact mass: 220.9840 Da
logP: 3.24Crippen estimate
Polar surface area: 4.9 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

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 1-Phenylpyrrole635-90-548 % similar 1-Bromo-3-fluorobenzene1073-06-943 % similar 1-Bromo-3-chlorobenzene108-37-243 % similar 3-Bromobiphenyl2113-57-741 % similar 3-Bromotoluene591-17-341 % similar 1-Bromo-3-iodobenzene591-18-441 % similar 3-Bromoaniline591-19-541 % similar

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

Same formula

1-(4-Bromophenyl)cyclopropanecarbonitrile124276-67-1 1-Bromo-2-naphthalenamine20191-75-7 1-Amino-4-bromonaphthalene2298-07-9 6-Bromo-4-methylquinoline41037-28-9 8-Bromo-1-naphthalenamine62456-34-2 6-Bromo-2-methylquinoline877-42-9

Elsewhere

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