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2-[4-(4-fluorophenoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-[4-(4-fluorophenoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Formula: C18H20BFO3

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(OC2=CC=C(F)C=C2)C=C1

IUPAC: 2-[4-(4-fluorophenoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C18H20BFO3/c1-17(2)18(3,4)23-19(22-17)13-5-9-15(10-6-13)21-16-11-7-14(20)8-12-16/h5-12H,1-4H3

Composition: C (68.82%), H (6.42%), B (3.44%), F (6.05%), O (15.28%)

Molar Mass: 314.16

Atom Count: 43

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 314.148953
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey KAYPYEFNCGPLIB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 82.17
Topological Polar Surface Area 27.69
Polarizability 33.97
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime Formula UnitPrice
98% <10 Days C18H20BFO3 Quote Only