dimethyl({2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl})amine

dimethyl({2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl})amine

CAS: 873078-93-4

Formula: C16H26BNO3

SMILES: CN(C)CCOC1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: dimethyl({2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl})amine

InChI: InChI=1S/C16H26BNO3/c1-15(2)16(3,4)21-17(20-15)13-7-9-14(10-8-13)19-12-11-18(5)6/h7-10H,11-12H2,1-6H3

Composition: C (65.99%), H (9.00%), B (3.71%), N (4.81%), O (16.48%)

Molar Mass: 291.2

Atom Count: 47

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	291.200574
Formal Charge	0
FSP3	0.62
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	JUVPIBHZWGVRFL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.2
Topological Polar Surface Area	30.93
Polarizability	33.57
Ring Count	2
Rotatable Bond Count	5

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