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

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

CAS: 1628014-71-0

Formula: C17H28BNO2

SMILES: CC(C)(C)NCC1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1

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

InChI: InChI=1S/C17H28BNO2/c1-15(2,3)19-12-13-8-10-14(11-9-13)18-20-16(4,5)17(6,7)21-18/h8-11,19H,12H2,1-7H3

Composition: C (70.60%), H (9.76%), B (3.74%), N (4.84%), O (11.06%)

Molar Mass: 289.23

Atom Count: 49

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 289.221309
Formal Charge 0
FSP3 0.65
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey QJBWHEPPDGGWLQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 82.77
Topological Polar Surface Area 30.49
Polarizability 34.76
Ring Count 2
Rotatable Bond Count 4

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