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

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

Formula: C13H15BClNO2

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

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

InChI: InChI=1S/C13H15BClNO2/c1-12(2)13(3,4)18-14(17-12)10-7-5-6-9(8-16)11(10)15/h5-7H,1-4H3

Composition: C (59.25%), H (5.74%), B (4.10%), Cl (13.45%), N (5.32%), O (12.14%)

Molar Mass: 263.53

Atom Count: 33

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	263.088436
Formal Charge	0
FSP3	0.46
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	XYFXKWAXQFIFKJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.24
Topological Polar Surface Area	42.25
Polarizability	27.73
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C13H15BClNO2		Quote Only