2-[3-bromo-5-(methylsulfanyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-[3-bromo-5-(methylsulfanyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 1256359-20-2

Formula: C13H18BBrO2S

SMILES: CSC1=CC(Br)=CC(=C1)B1OC(C)(C)C(C)(C)O1

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

InChI: InChI=1S/C13H18BBrO2S/c1-12(2)13(3,4)17-14(16-12)9-6-10(15)8-11(7-9)18-5/h6-8H,1-5H3

Composition: C (47.45%), H (5.51%), B (3.29%), Br (24.28%), O (9.72%), S (9.74%)

Molar Mass: 329.06

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	328.030394
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	WPCGZCGXKQLVBR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	76.09
Topological Polar Surface Area	18.46
Polarizability	31.6
Ring Count	2
Rotatable Bond Count	2

Suppliers

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<6 Days	1256359-20-2		$491.05-$1,033.85$491.05$1,033.85