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2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-ol

2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-ol

CAS: 1309980-11-7

Formula: C15H23BO3

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

IUPAC: 2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-ol

InChI: InChI=1S/C15H23BO3/c1-13(2,17)11-8-7-9-12(10-11)16-18-14(3,4)15(5,6)19-16/h7-10,17H,1-6H3

Composition: C (68.72%), H (8.84%), B (4.12%), O (18.31%)

Molar Mass: 262.16

Atom Count: 42

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 262.174025
Formal Charge 0
FSP3 0.6
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey NNPQWBXXZHNLAW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.59
Topological Polar Surface Area 38.69
Polarizability 30.14
Ring Count 2
Rotatable Bond Count 2

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