3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

CAS: 945256-29-1

Formula: C13H17BN2O2

SMILES: CC1(C)OB(OC1(C)C)C1=CNC2=NC=CC=C12

IUPAC: 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

InChI: InChI=1S/C13H17BN2O2/c1-12(2)13(3,4)18-14(17-12)10-8-16-11-9(10)6-5-7-15-11/h5-8H,1-4H3,(H,15,16)

Composition: C (63.97%), H (7.02%), B (4.43%), N (11.48%), O (13.11%)

Molar Mass: 244.1

Atom Count: 35

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	244.138308
Formal Charge	0
FSP3	0.46
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	UDWFQODVYQOMET-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.6
Topological Polar Surface Area	47.14
Polarizability	27.66
Ring Count	3
Rotatable Bond Count	1

Suppliers

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<6 Days	945256-29-1		$43.70-$142.60$43.70$86.25$128.80$142.60

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<7 Days	945256-29-1		$46.58-$162.50$46.58$90.05$162.50

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	945256-29-1		$997.00-$2,400.00$997.00$2,400.00

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<5 Days	945256-29-1		$402.26$402.26