3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carbonitrile

3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carbonitrile

CAS: 1220219-63-5

Formula: C12H14BClN2O2

SMILES: CC1(C)OB(OC1(C)C)C1=CN=C(C#N)C(Cl)=C1

IUPAC: 3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carbonitrile

InChI: InChI=1S/C12H14BClN2O2/c1-11(2)12(3,4)18-13(17-11)8-5-9(14)10(6-15)16-7-8/h5,7H,1-4H3

Composition: C (54.49%), H (5.34%), B (4.09%), Cl (13.40%), N (10.59%), O (12.10%)

Molar Mass: 264.52

Atom Count: 32

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	264.083685
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	NSDGGJWBPMKOJP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.71
Topological Polar Surface Area	55.14
Polarizability	26.86
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1220219-63-5		$40.35-$172.76$40.35$66.83$172.76