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2-(5-fluoro-2-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(5-fluoro-2-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 1030832-38-2

Formula: C13H18BFO2

SMILES: CC1=CC=C(F)C=C1B1OC(C)(C)C(C)(C)O1

IUPAC: 2-(5-fluoro-2-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C13H18BFO2/c1-9-6-7-10(15)8-11(9)14-16-12(2,3)13(4,5)17-14/h6-8H,1-5H3

Composition: C (66.14%), H (7.69%), B (4.58%), F (8.05%), O (13.55%)

Molar Mass: 236.09

Atom Count: 35

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 236.138388
Formal Charge 0
FSP3 0.54
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey ZTKSYTPCVNDCIE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.97
Topological Polar Surface Area 18.46
Polarizability 25.42
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1030832-38-2 $25.22-$257.24$25.22$66.83$257.24
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