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Chem 2 Bromobiphenyl | Cheminformatics

2-Bromobiphenyl


  • SKU Code: CH137986
Chemical Name - 2-Bromobiphenyl
Mol Weight - 233.107
Smiles - Brc(cccc1)c1-c1ccccc1
Property Name Property Value
Mol Name2-Bromobiphenyl
Molweight233.107
Monoisotopic Mass231.988761
Clogp4.044
Clogs-4.536
Total Surface Area151.65
Druglikeness-3.9741
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.61538
Molecular Flexibility0.35488
Molecular Complexity0.59634
Fragments1
Non H Atoms13
Non Ch Atoms1
Electronegative Atoms1
Rotatable Bonds1
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Symmetric Atoms2
SmilesBrc(cccc1)c1-c1ccccc1
InChIKeyInChI=1S/C12H9Br/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H
InChIKTADSLDAUJLZGL-UHFFFAOYSA-N

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1 - 2-Bromobiphenyl
2 - 2-Bromobiphenyl
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