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2-(2,3-difluoro-6-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(2,3-difluoro-6-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Formula: C13H17BF2O3

SMILES: COC1=C(B2OC(C)(C)C(C)(C)O2)C(F)=C(F)C=C1

IUPAC: 2-(2,3-difluoro-6-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C13H17BF2O3/c1-12(2)13(3,4)19-14(18-12)10-9(17-5)7-6-8(15)11(10)16/h6-7H,1-5H3

Composition: C (57.81%), H (6.34%), B (4.00%), F (14.07%), O (17.77%)

Molar Mass: 270.08

Atom Count: 36

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 270.123881
Formal Charge 0
FSP3 0.54
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey GJWVHXVYEOZQIG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.61
Topological Polar Surface Area 27.69
Polarizability 25.92
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime Formula UnitPrice
98% <10 Days C13H17BF2O3 Quote Only