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{[4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}dimethylamine hydrochloride

{[4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}dimethylamine hydrochloride

Formula: C15H24BClFNO2

SMILES: Cl.CN(C)CC1=CC(B2OC(C)(C)C(C)(C)O2)=C(F)C=C1

IUPAC: {[4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}dimethylamine hydrochloride

InChI: InChI=1S/C15H23BFNO2.ClH/c1-14(2)15(3,4)20-16(19-14)12-9-11(10-18(5)6)7-8-13(12)17;/h7-9H,10H2,1-6H3;1H

Composition: C (57.08%), H (7.66%), B (3.43%), Cl (11.23%), F (6.02%), N (4.44%), O (10.14%)

Molar Mass: 315.62

Atom Count: 45

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 315.157265
Formal Charge 0
FSP3 0.6
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey KSISFUFRUJHSCG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.47
Topological Polar Surface Area 21.7
Polarizability 30.7
Ring Count 2
Rotatable Bond Count 3

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C15H24BClFNO2 Quote Only