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

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

CAS: 2490665-88-6

Formula: C16H26BNO3

SMILES: COCCNCC1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1

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

InChI: InChI=1S/C16H26BNO3/c1-15(2)16(3,4)21-17(20-15)14-8-6-13(7-9-14)12-18-10-11-19-5/h6-9,18H,10-12H2,1-5H3

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 1
InChIKey UVELOBSBKNXVMQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80
Topological Polar Surface Area 39.72
Polarizability 33.59
Ring Count 2
Rotatable Bond Count 6

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