2-(3-fluorophenyl)-1,3,2-dioxaborinane

2-(3-fluorophenyl)-1,3,2-dioxaborinane

Formula: C9H10BFO2

SMILES: FC1=CC=CC(=C1)B1OCCCO1

IUPAC: 2-(3-fluorophenyl)-1,3,2-dioxaborinane

InChI: InChI=1S/C9H10BFO2/c11-9-4-1-3-8(7-9)10-12-5-2-6-13-10/h1,3-4,7H,2,5-6H2

Composition: C (60.06%), H (5.60%), B (6.01%), F (10.56%), O (17.78%)

Molar Mass: 179.99

Atom Count: 23

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	180.075788
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	DZJAYVOWFXQZGE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.68
Topological Polar Surface Area	18.46
Polarizability	18.14
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H10BFO2		Quote Only