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2-{4'-methoxy-[1,1'-biphenyl]-4-yl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-{4'-methoxy-[1,1'-biphenyl]-4-yl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 446311-34-8

Formula: C19H23BO3

SMILES: COC1=CC=C(C=C1)C1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: 2-{4'-methoxy-[1,1'-biphenyl]-4-yl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C19H23BO3/c1-18(2)19(3,4)23-20(22-18)16-10-6-14(7-11-16)15-8-12-17(21-5)13-9-15/h6-13H,1-5H3

Composition: C (73.57%), H (7.47%), B (3.48%), O (15.47%)

Molar Mass: 310.2

Atom Count: 46

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 310.174025
Formal Charge 0
FSP3 0.37
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey XIWRWTPGYBTKPL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 87.31
Topological Polar Surface Area 27.69
Polarizability 37.53
Ring Count 3
Rotatable Bond Count 3

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