5-(benzyloxy)-1H-indol-2-ylboronic acid

5-(benzyloxy)-1H-indol-2-ylboronic acid

CAS: 2408430-19-1

Formula: C15H14BNO3

SMILES: OB(O)C1=CC2=CC(OCC3=CC=CC=C3)=CC=C2N1

IUPAC: [5-(benzyloxy)-1H-indol-2-yl]boronic acid

InChI: InChI=1S/C15H14BNO3/c18-16(19)15-9-12-8-13(6-7-14(12)17-15)20-10-11-4-2-1-3-5-11/h1-9,17-19H,10H2

Composition: C (67.45%), H (5.28%), B (4.05%), N (5.24%), O (17.97%)

Molar Mass: 267.09

Atom Count: 34

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	267.106673
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	YYDOJFCOBUGCRB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.02
Topological Polar Surface Area	65.48
Polarizability	30.88
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	2408430-19-1		$179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70