2-fluoro-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

2-fluoro-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

CAS: 1150561-71-9

Formula: C12H17BFNO2

SMILES: CC1=C(F)N=CC(=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: 2-fluoro-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

InChI: InChI=1S/C12H17BFNO2/c1-8-6-9(7-15-10(8)14)13-16-11(2,3)12(4,5)17-13/h6-7H,1-5H3

Composition: C (60.79%), H (7.23%), B (4.56%), F (8.01%), N (5.91%), O (13.50%)

Molar Mass: 237.08

Atom Count: 34

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	237.133637
Formal Charge	0
FSP3	0.58
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	OEMBRPGPDHAQHU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.83
Topological Polar Surface Area	31.35
Polarizability	24.54
Ring Count	2
Rotatable Bond Count	1

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