2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

CAS: 269409-97-4

Formula: C12H17BO3

SMILES: CC1(C)OB(OC1(C)C)C1=C(O)C=CC=C1

IUPAC: 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

InChI: InChI=1S/C12H17BO3/c1-11(2)12(3,4)16-13(15-11)9-7-5-6-8-10(9)14/h5-8,14H,1-4H3

Composition: C (65.49%), H (7.79%), B (4.91%), O (21.81%)

Molar Mass: 220.08

Atom Count: 33

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	220.127074
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	VLROJECCXBBKPZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.69
Topological Polar Surface Area	38.69
Polarizability	24.6
Ring Count	2
Rotatable Bond Count	1

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