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Chem 1 Bromo 3 Methoxy Benzene | Cheminformatics

(1-Bromo-3-Methoxy Benzene)


  • SKU Code: CH137760
Chemical Name - (1-Bromo-3-Methoxy Benzene)
Mol Weight - 187.036
Smiles - COc1cccc(Br)c1
Property Name Property Value
Mol Name(1-Bromo-3-Methoxy Benzene)
Molweight187.036
Monoisotopic Mass185.968026
Clogp2.3148
Clogs-2.468
H Acceptors1
Total Surface Area114.15
Relative Psa0.087604
Polar Surface Area9.23
Druglikeness-3.8746
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.66667
Molecular Flexibility0.28257
Molecular Complexity0.67701
Fragments1
Non H Atoms9
Non Ch Atoms2
Electronegative Atoms2
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms2
SmilesCOc1cccc(Br)c1
InChIKeyInChI=1S/C7H7BrO/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3
InChIPLDWAJLZAAHOGG-UHFFFAOYSA-N

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1 - (1-Bromo-3-Methoxy Benzene)
2 - (1-Bromo-3-Methoxy Benzene)
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