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3,4-dibromo-2-[(E)-[(2-hydroxy-3,5-dimethylphenyl)imino]methyl]-6-methoxyphenol

3,4-dibromo-2-[(E)-[(2-hydroxy-3,5-dimethylphenyl)imino]methyl]-6-methoxyphenol

Formula: C16H15Br2NO3

SMILES: COC1=CC(Br)=C(Br)C(C=NC2=CC(C)=CC(C)=C2O)=C1O

IUPAC: 3,4-dibromo-2-[(E)-[(2-hydroxy-3,5-dimethylphenyl)imino]methyl]-6-methoxyphenol

InChI: InChI=1S/C16H15Br2NO3/c1-8-4-9(2)15(20)12(5-8)19-7-10-14(18)11(17)6-13(22-3)16(10)21/h4-7,20-21H,1-3H3/b19-7+

Composition: C (44.79%), H (3.52%), Br (37.24%), N (3.26%), O (11.19%)

Molar Mass: 429.108

Atom Count: 37

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 426.941869
Formal Charge 0
FSP3 0.19
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey JQOYJLMIXDZUTN-FBCYGCLPSA-N
Lipinski's Rule of Five
Molar Refractivity 97.14
Topological Polar Surface Area 62.05
Polarizability 35.46
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H15Br2NO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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