N-{[2-fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}cyclohexanamine

N-{[2-fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}cyclohexanamine

Formula: C19H29BFNO2

SMILES: CC1(C)OB(OC1(C)C)C1=C(CNC2CCCCC2)C(F)=CC=C1

IUPAC: N-{[2-fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}cyclohexanamine

InChI: InChI=1S/C19H29BFNO2/c1-18(2)19(3,4)24-20(23-18)16-11-8-12-17(21)15(16)13-22-14-9-6-5-7-10-14/h8,11-12,14,22H,5-7,9-10,13H2,1-4H3

Composition: C (68.48%), H (8.77%), B (3.24%), F (5.70%), N (4.20%), O (9.60%)

Molar Mass: 333.25

Atom Count: 53

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	333.227537
Formal Charge	0
FSP3	0.68
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CGRNAABMNROMQK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	90.19
Topological Polar Surface Area	30.49
Polarizability	37.33
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C19H29BFNO2		Quote Only