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

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

CAS: 1622217-20-2

Formula: C13H17BFNO4

SMILES: COC(=O)C1=CC(=CN=C1F)B1OC(C)(C)C(C)(C)O1

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

InChI: InChI=1S/C13H17BFNO4/c1-12(2)13(3,4)20-14(19-12)8-6-9(11(17)18-5)10(15)16-7-8/h6-7H,1-5H3

Composition: C (55.55%), H (6.10%), B (3.85%), F (6.76%), N (4.98%), O (22.77%)

Molar Mass: 281.09

Atom Count: 37

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	281.123466
Formal Charge	0
FSP3	0.54
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	WSPHCRVNJOWFOY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.81
Topological Polar Surface Area	57.65
Polarizability	27.27
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<5 Days	1622217-20-2		$39.09-$170.24$39.09$68.09$170.24