2-[3-(bromomethyl)-4-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-[3-(bromomethyl)-4-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 1544739-25-4

Formula: C13H17BBrFO2

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

IUPAC: 2-[3-(bromomethyl)-4-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C13H17BBrFO2/c1-12(2)13(3,4)18-14(17-12)10-5-6-11(16)9(7-10)8-15/h5-7H,8H2,1-4H3

Composition: C (49.57%), H (5.44%), B (3.43%), Br (25.37%), F (6.03%), O (10.16%)

Molar Mass: 314.99

Atom Count: 35

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	314.048901
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	BQOMTZAOMQFSJP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.78
Topological Polar Surface Area	18.46
Polarizability	28.22
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1544739-25-4		$39.09-$646.89$39.09$66.83$177.80$646.89