4-{[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}morpholine hydrochloride

4-{[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}morpholine hydrochloride

CAS: 944591-57-5

Formula: C17H27BClNO3

SMILES: Cl.CC1(C)OB(OC1(C)C)C1=CC=C(CN2CCOCC2)C=C1

IUPAC: 4-{[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}morpholine hydrochloride

InChI: InChI=1S/C17H26BNO3.ClH/c1-16(2)17(3,4)22-18(21-16)15-7-5-14(6-8-15)13-19-9-11-20-12-10-19;/h5-8H,9-13H2,1-4H3;1H

Composition: C (60.11%), H (8.01%), B (3.18%), Cl (10.44%), N (4.12%), O (14.13%)

Molar Mass: 339.67

Atom Count: 50

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	339.177251
Formal Charge	0
FSP3	0.65
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	XUHPRNOSIRFDFA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.33
Topological Polar Surface Area	30.93
Polarizability	34.7
Ring Count	3
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	944591-57-5		$34.05-$102.14$34.05$102.14