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

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

CAS: 445303-67-3

Formula: C13H15BF4O2

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

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

InChI: InChI=1S/C13H15BF4O2/c1-11(2)12(3,4)20-14(19-11)8-5-6-9(10(15)7-8)13(16,17)18/h5-7H,1-4H3

Composition: C (53.83%), H (5.21%), B (3.73%), F (26.20%), O (11.03%)

Molar Mass: 290.06

Atom Count: 35

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	290.110122
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FPCSARGPMNDYAO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.9
Topological Polar Surface Area	18.46
Polarizability	24.87
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	445303-67-3		$27.74-$327.86$27.74$105.92$327.86