chempirical

2-Bromoindene

C9H7BrCAS 10485-09-3195.06 g/mol

Open in Covalent MOL file
Br
AlkeneVinyl halide

Properties

Molecular formula
C9H7Br
Molar mass
195.06 g/mol
Exact mass
193.9731 Da
logP
2.98Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
10485-09-3
SMILES
C1C2=CC=CC=C2C=C1Br
InChIKey
CCUYEVNCRQDQRF-UHFFFAOYSA-N
InChI
InChI=1S/C9H7Br/c10-9-5-7-3-1-2-4-8(7)6-9/h1-5H,6H2

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Names and synonyms

1 names
  • 1H-Indene, 2-bromo-

Work with 2-Bromoindene

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

2-Methylindene2177-47-153 % similar Indene95-13-635 % similar Dialin447-53-033 % similar 1,4-Dihydronaphthalene612-17-932 % similar 2-Bromostyrene2039-88-531 % similar Benzocyclobutene694-87-131 % similar 1H-Inden-2(3H)-one oxime3349-63-130 % similar 1,2-Benzenediacetic acid7500-53-030 % similar

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

Elsewhere

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