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

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

Formula: C16H27BClNO2

SMILES: Cl.CCCNCC1=CC=CC=C1B1OC(C)(C)C(C)(C)O1

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

InChI: InChI=1S/C16H26BNO2.ClH/c1-6-11-18-12-13-9-7-8-10-14(13)17-19-15(2,3)16(4,5)20-17;/h7-10,18H,6,11-12H2,1-5H3;1H

Composition: C (61.66%), H (8.73%), B (3.47%), Cl (11.37%), N (4.49%), O (10.27%)

Molar Mass: 311.66

Atom Count: 48

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	311.182337
Formal Charge	0
FSP3	0.62
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XLPBCAAUBXRZJO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.23
Topological Polar Surface Area	30.49
Polarizability	32.92
Ring Count	2
Rotatable Bond Count	5

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C16H27BClNO2		Quote Only