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2-{[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]sulfanyl}pyridine

2-{[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]sulfanyl}pyridine

Formula: C12H18BNO2S

SMILES: CC1(C)OB(CSC2=CC=CC=N2)OC1(C)C

IUPAC: 2-{[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]sulfanyl}pyridine

InChI: InChI=1S/C12H18BNO2S/c1-11(2)12(3,4)16-13(15-11)9-17-10-7-5-6-8-14-10/h5-8H,9H2,1-4H3

Composition: C (57.39%), H (7.22%), B (4.30%), N (5.58%), O (12.74%), S (12.77%)

Molar Mass: 251.15

Atom Count: 35

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 251.11513
Formal Charge 0
FSP3 0.58
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey LPQJBYRUPQITQG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.25
Topological Polar Surface Area 31.35
Polarizability 28.02
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime Formula UnitPrice
98% <10 Days C12H18BNO2S Quote Only