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5-bromo-6-methylpyridin-3-ylboronic acid

5-bromo-6-methylpyridin-3-ylboronic acid

Formula: C6H7BBrNO2

SMILES: CC1=C(Br)C=C(C=N1)B(O)O

IUPAC: (5-bromo-6-methylpyridin-3-yl)boronic acid

InChI: InChI=1S/C6H7BBrNO2/c1-4-6(8)2-5(3-9-4)7(10)11/h2-3,10-11H,1H3

Composition: C (33.39%), H (3.27%), B (5.01%), Br (37.02%), N (6.49%), O (14.82%)

Molar Mass: 215.84

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 214.975321
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey DQGDXNZOPUNCKT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.66
Topological Polar Surface Area 53.35
Polarizability 17.32
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime Formula PacketSize UnitPrice
97% <7 Days C6H7BBrNO2 $198.22-$7,425.77$198.22$293.59$663.85$2,166.40$7,425.77
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98% <10 Days C6H7BBrNO2 Quote Only
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