tert-butyl 2-{[3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]amino}acetate

tert-butyl 2-{[3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]amino}acetate

Formula: C18H29BN2O4

SMILES: CC1=C(NCC(=O)OC(C)(C)C)N=CC(=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: tert-butyl 2-{[3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]amino}acetate

InChI: InChI=1S/C18H29BN2O4/c1-12-9-13(19-24-17(5,6)18(7,8)25-19)10-20-15(12)21-11-14(22)23-16(2,3)4/h9-10H,11H2,1-8H3,(H,20,21)

Composition: C (62.08%), H (8.39%), B (3.10%), N (8.04%), O (18.38%)

Molar Mass: 348.25

Atom Count: 54

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	348.222037
Formal Charge	0
FSP3	0.67
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	QIDGTRMJEWBLAO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.76
Topological Polar Surface Area	69.68
Polarizability	37.82
Ring Count	2
Rotatable Bond Count	6

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C18H29BN2O4		Quote Only