Text Search
Structure Search

2-(2-bromo-4-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(2-bromo-4-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Formula: C12H15BBrFO2

SMILES: CC1(C)OB(OC1(C)C)C1=C(Br)C=C(F)C=C1

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

InChI: InChI=1S/C12H15BBrFO2/c1-11(2)12(3,4)17-13(16-11)9-6-5-8(15)7-10(9)14/h5-7H,1-4H3

Composition: C (47.89%), H (5.02%), B (3.59%), Br (26.55%), F (6.31%), O (10.63%)

Molar Mass: 300.96

Atom Count: 32

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 300.033251
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey KEDMXIHAXBLVJU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.55
Topological Polar Surface Area 18.46
Polarizability 26.5
Ring Count 2
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C12H15BBrFO2 Quote Only