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2D Structure

4-Bromo-o-xylene


  • SKU Code: CH137083
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Chemical Name - 4-Bromo-o-xylene
Mol Weight - 185.063
Smiles - Cc(cc1)c(C)cc1Br
Property Name Property Value
Mol Name4-Bromo-o-xylene
Molweight185.063
Monoisotopic Mass183.988761
Clogp3.0726
Clogs-3.138
Total Surface Area116.41
Druglikeness-4.2499
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.66667
Molecular Complexity0.72259
Fragments1
Non H Atoms9
Non Ch Atoms1
Electronegative Atoms1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms2
SmilesCc(cc1)c(C)cc1Br
InChIKeyInChI=1S/C8H9Br/c1-6-3-4-8(9)5-7(6)2/h3-5H,1-2H3
InChIQOGHRLGTXVMRLM-UHFFFAOYSA-N

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