6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-spiro[indole-3,4'-oxan]-2-one

6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-spiro[indole-3,4'-oxan]-2-one

CAS: 1190861-50-7

Formula: C18H24BNO4

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C2C(NC(=O)C22CCOCC2)=C1

IUPAC: 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-dihydrospiro[indole-3,4'-oxan]-2-one

InChI: InChI=1S/C18H24BNO4/c1-16(2)17(3,4)24-19(23-16)12-5-6-13-14(11-12)20-15(21)18(13)7-9-22-10-8-18/h5-6,11H,7-10H2,1-4H3,(H,20,21)

Composition: C (65.67%), H (7.35%), B (3.28%), N (4.25%), O (19.44%)

Molar Mass: 329.2

Atom Count: 48

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	329.179838
Formal Charge	0
FSP3	0.61
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	LDFKVOXNBMNHFU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.86
Topological Polar Surface Area	56.79
Polarizability	35.48
Ring Count	4
Rotatable Bond Count	1

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95%	<5 Days	1190861-50-7		$3,400.00$3,400.00