2-(2-chlorophenyl)-5,5-dimethyl-1,3,2-dioxaborinane

2-(2-chlorophenyl)-5,5-dimethyl-1,3,2-dioxaborinane

CAS: 346656-42-6

Formula: C11H14BClO2

SMILES: CC1(C)COB(OC1)C1=CC=CC=C1Cl

IUPAC: 2-(2-chlorophenyl)-5,5-dimethyl-1,3,2-dioxaborinane

InChI: InChI=1S/C11H14BClO2/c1-11(2)7-14-12(15-8-11)9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3

Composition: C (58.85%), H (6.29%), B (4.82%), Cl (15.79%), O (14.25%)

Molar Mass: 224.49

Atom Count: 29

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	224.077537
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	HTKUDRCYEPYTOR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.03
Topological Polar Surface Area	18.46
Polarizability	24.03
Ring Count	2
Rotatable Bond Count	1

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