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6-fluoro-4-methylpyridin-3-ylboronic acid

6-fluoro-4-methylpyridin-3-ylboronic acid

CAS: 1072944-18-3

Formula: C6H7BFNO2

SMILES: CC1=CC(F)=NC=C1B(O)O

IUPAC: (6-fluoro-4-methylpyridin-3-yl)boronic acid

InChI: InChI=1S/C6H7BFNO2/c1-4-2-6(8)9-3-5(4)7(10)11/h2-3,10-11H,1H3

Composition: C (46.51%), H (4.55%), B (6.98%), F (12.26%), N (9.04%), O (20.65%)

Molar Mass: 154.94

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 155.055387
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey BAVHOAIWOSIBRD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.72
Topological Polar Surface Area 53.35
Polarizability 14.14
Ring Count 1
Rotatable Bond Count 1

Suppliers

Purity (%)
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1072944-18-3 $51.35-$653.32$51.35$63.37$86.31$232.70$419.52$653.32
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Kinentia Biosciences LLC
Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 1072944-18-3 $158.76-$595.35$158.76$595.35
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