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2-(4-benzoylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(4-benzoylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 269410-03-9

Formula: C19H21BO3

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

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

InChI: InChI=1S/C19H21BO3/c1-18(2)19(3,4)23-20(22-18)16-12-10-15(11-13-16)17(21)14-8-6-5-7-9-14/h5-13H,1-4H3

Composition: C (74.05%), H (6.87%), B (3.51%), O (15.57%)

Molar Mass: 308.18

Atom Count: 44

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 308.158375
Formal Charge 0
FSP3 0.32
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey AKQXNDKEDAWVMZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 86.29
Topological Polar Surface Area 35.53
Polarizability 35.67
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 269410-03-9 $45.40-$170.24$45.40$170.24
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