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2-[4-chloro-2-fluoro-3-(methoxymethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-[4-chloro-2-fluoro-3-(methoxymethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Formula: C14H19BClFO4

SMILES: COCOC1=C(Cl)C=CC(B2OC(C)(C)C(C)(C)O2)=C1F

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

InChI: InChI=1S/C14H19BClFO4/c1-13(2)14(3,4)21-15(20-13)9-6-7-10(16)12(11(9)17)19-8-18-5/h6-7H,8H2,1-5H3

Composition: C (53.12%), H (6.05%), B (3.41%), Cl (11.20%), F (6.00%), O (20.22%)

Molar Mass: 316.56

Atom Count: 40

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 316.104895
Formal Charge 0
FSP3 0.57
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey IDKWGYGCHMFJBP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.05
Topological Polar Surface Area 36.92
Polarizability 30.69
Ring Count 2
Rotatable Bond Count 4

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <10 Days C14H19BClFO4 Quote Only