7-Bromo-1-benzofuran

C₈H₅BrOCAS 133720-60-2197.03 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₅BrO
Molar mass: 197.03 g/mol
Exact mass: 195.9524 Da
logP: 3.20Crippen estimate
Polar surface area: 13.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

133720-60-2

SMILES

C1=CC2=C(C(=C1)Br)OC=C2

InChIKey

GPZPQJITKRSVQJ-UHFFFAOYSA-N

InChI

InChI=1S/C8H5BrO/c9-7-3-1-2-6-4-5-10-8(6)7/h1-5H

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Names and synonyms

1 names

7-Bromobenzo[B]furan

Work with 7-Bromo-1-benzofuran

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

8-Bromoquinoline16567-18-340 % similar 2,3-Dibromonaphthalene13214-70-538 % similar 1-Bromo-8-chloronaphthalene20816-79-937 % similar 8-Bromo-1-naphthalenamine62456-34-235 % similar 1,2-Dibromobenzene583-53-935 % similar 1-Bromo-8-phenylnaphthalene1121545-24-133 % similar 4-Bromopyrene1732-26-933 % similar 7-Bromo-1H-indazole53857-58-233 % similar

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

Same formula

6-Bromobenzofuran128851-73-0 4-Bromobenzofuran128868-60-0

Elsewhere

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