2-(hex-1-yn-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(hex-1-yn-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 159087-40-8

Formula: C12H21BO2

SMILES: CCCCC#CB1OC(C)(C)C(C)(C)O1

IUPAC: 2-(hex-1-yn-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C12H21BO2/c1-6-7-8-9-10-13-14-11(2,3)12(4,5)15-13/h6-8H2,1-5H3

Composition: C (69.26%), H (10.17%), B (5.19%), O (15.38%)

Molar Mass: 208.11

Atom Count: 36

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	208.16346
Formal Charge	0
FSP3	0.83
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RYRRXQHUSGAWQX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.53
Topological Polar Surface Area	18.46
Polarizability	24.38
Ring Count	1
Rotatable Bond Count	4

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	159087-40-8		$51.35-$225.06$51.35$63.37$86.31$143.12$225.06

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<6 Days	159087-40-8		$241.50-$478.40$241.50$258.75$289.80$368.00$478.40